SMILES for Diacylglycerol O-acyltransferase 1

1488 SMILES Strings for Diacylglycerol O-acyltransferase 1

Compound Name	SMILES String
BDBM50003856	CC1(C)Oc2ncnc(N)c2N=C1c1ccc(cc1)[C@H]1CC[C@@H](CC1)C(O)=O \|r,wU:19.21,wD:22.28,c:12,(6.26,-59.02,;4.72,-59.02,;5.49,-60.36,;3.39,-59.8,;2.06,-59.04,;.72,-59.82,;-.62,-59.04,;-.62,-57.5,;.72,-56.73,;.71,-55.19,;2.05,-57.49,;3.38,-56.72,;4.72,-57.48,;6.05,-56.7,;7.38,-57.47,;8.71,-56.69,;8.7,-55.15,;7.35,-54.39,;6.03,-55.17,;10.03,-54.37,;10,-52.83,;11.34,-52.06,;12.68,-52.82,;12.68,-54.36,;11.36,-55.13,;14.01,-52.05,;15.35,-52.81,;14.01,-50.51,)\|
BDBM50003859	Cc1nc(N)c2N=C(c3ccc(cc3)[C@H]3CC[C@H](CC(O)=O)CC3)C(C)(C)Oc2n1 \|r,wU:14.14,wD:17.18,t:6,(.98,-9.8,;2.31,-9.03,;2.32,-7.49,;3.64,-6.72,;3.64,-5.18,;4.98,-7.48,;6.31,-6.71,;7.64,-7.47,;8.97,-6.69,;10.3,-7.46,;11.63,-6.68,;11.62,-5.14,;10.28,-4.38,;8.95,-5.16,;12.95,-4.36,;12.93,-2.82,;14.26,-2.05,;15.6,-2.81,;16.93,-2.04,;18.27,-2.8,;18.28,-4.34,;19.61,-2.02,;15.61,-4.35,;14.28,-5.12,;7.65,-9.01,;9.19,-9.01,;8.42,-10.35,;6.32,-9.79,;4.98,-9.03,;3.65,-9.8,)\|
BDBM50003863	CC1(C)Oc2ncnc(N)c2N=C1c1ccc(cc1)[C@H]1CC[C@H](CS(N)(=O)=O)CC1 \|r,wU:19.21,wD:22.25,c:12,(8.17,-20.46,;6.63,-20.46,;7.4,-21.8,;5.3,-21.24,;3.97,-20.48,;2.64,-21.25,;1.3,-20.48,;1.3,-18.94,;2.63,-18.17,;2.63,-16.63,;3.97,-18.93,;5.29,-18.16,;6.63,-18.92,;7.96,-18.14,;9.29,-18.91,;10.62,-18.13,;10.61,-16.59,;9.26,-15.83,;7.94,-16.61,;11.94,-15.81,;11.92,-14.27,;13.25,-13.5,;14.59,-14.26,;15.92,-13.48,;17.26,-14.25,;17.27,-15.79,;18.02,-12.91,;18.8,-14.24,;14.6,-15.8,;13.27,-16.57,)\|
BDBM50003864	CC1(C)Oc2ncnc(N)c2C=C1c1ccc(cc1)[C@H]1CC[C@H](CC(O)=O)CC1 \|r,wU:19.21,wD:22.25,c:12,(42.97,-20.87,;41.43,-20.87,;42.2,-22.2,;40.1,-21.65,;38.77,-20.88,;37.43,-21.66,;36.1,-20.89,;36.1,-19.34,;37.43,-18.57,;37.43,-17.03,;38.77,-19.34,;40.09,-18.56,;41.43,-19.32,;42.76,-18.55,;44.09,-19.31,;45.42,-18.54,;45.41,-17,;44.06,-16.23,;42.74,-17.02,;46.74,-16.22,;46.72,-14.68,;48.05,-13.9,;49.39,-14.66,;50.72,-13.89,;52.06,-14.65,;52.07,-16.19,;53.39,-13.88,;49.39,-16.2,;48.07,-16.98,)\|
BDBM50003713	CC1(C)Oc2ncnc(N)c2C=C1c1ccc2c(CC[C@@]22CC[C@H](CC(O)=O)CC2)c1 \|r,wU:20.22,wD:23.26,c:12,(61.12,-21.75,;59.58,-21.75,;60.35,-23.09,;58.25,-22.53,;56.91,-21.76,;55.58,-22.54,;54.24,-21.77,;54.25,-20.23,;55.57,-19.46,;55.57,-17.92,;56.91,-20.22,;58.24,-19.45,;59.57,-20.21,;60.9,-19.43,;60.88,-17.9,;62.21,-17.12,;63.56,-17.88,;63.57,-19.42,;65.03,-19.88,;65.93,-18.63,;65.01,-17.39,;63.91,-16.31,;64.31,-14.82,;65.79,-14.42,;66.19,-12.93,;67.68,-12.52,;68.77,-13.61,;68.08,-11.03,;66.88,-15.5,;66.49,-16.98,;62.24,-20.2,)\|
BDBM50003715	Nc1ncnc2OCC(=Nc12)c1ccc(Br)cc1 \|c:8\|
BDBM50003717	Nc1nc(N)c2N=C(COc2n1)c1ccc(Br)cc1 \|c:6\|
BDBM50003719	Nc1nc(O)nc2OCC(=Nc12)c1ccc(Br)cc1 \|c:9\|
BDBM50003726	C[C@H]1Oc2ncnc(N)c2N[C@H]1c1ccc(Br)cc1 \|r\|
BDBM50003721	CN(C)c1ncnc2OCC(=Nc12)c1ccc(Br)cc1 \|c:10\|
BDBM50003724	CC1(C)Oc2ncnc(N)c2N=C1c1ccc(Br)cc1 \|c:12\|
BDBM50003730	CC1(C)Oc2ncnc(N)c2N=C1c1ccc(F)cc1 \|c:12\|
BDBM50003732	CCc1ccc(cc1)C1=Nc2c(N)ncnc2OC1(C)C \|t:9\|
BDBM50003728	CC1(C)Oc2ncnc(N)c2N=C1c1ccccc1 \|c:12\|
BDBM50003807	CC1(C)Oc2ncnc(N)c2N=C1c1ccc(cc1)C1CCCCC1 \|c:12\|
BDBM50003835	COc1ccc(cc1)C1=Nc2c(N)ncnc2OC1(C)C \|t:9\|
BDBM50003735	CC(C)c1ccc(cc1)C1=Nc2c(N)ncnc2OC1(C)C \|t:10\|
BDBM50003853	CC1(C)Oc2ncnc(N)c2N=C1c1ccc(cc1)C1CCC(=O)CC1 \|c:12\|
BDBM50003849	CC1(C)Oc2ncnc(N)c2N=C1c1ccc(cc1)N1CCOCC1 \|c:12\|
BDBM20716	OC(=O)[C@@H]1CCC[C@H]1C(=O)c1ccc(cc1)-c1ccc(NC(=O)Nc2ccccc2)cc1 \|r\|
BDBM20718	OC(=O)[C@@H]1CCC[C@H]1C(=O)c1ccc(cc1)-c1ccc(NC(=O)Nc2ccccc2C(F)(F)F)cc1 \|r\|
BDBM20719	OC(=O)[C@@H]1CCC[C@H]1C(=O)c1ccc(cc1)-c1ccc(NC(=O)Nc2cccc(c2)C(F)(F)F)cc1 \|r\|
BDBM20720	OC(=O)[C@@H]1CCC[C@H]1C(=O)c1ccc(cc1)-c1ccc(NC(=O)Nc2cccc(F)c2)cc1 \|r\|
BDBM20721	OC(=O)[C@@H]1CCC[C@H]1C(=O)c1ccc(cc1)-c1ccc(NC(=O)Nc2cccc(Cl)c2)cc1 \|r\|
BDBM20722	OC(=O)[C@@H]1CCC[C@H]1C(=O)c1ccc(cc1)-c1ccc(NC(=O)Nc2cc(ccc2F)C(F)(F)F)cc1 \|r\|
BDBM20723	CNC(=O)c1cccc(NC(=O)Nc2ccc(cc2)-c2ccc(cc2)C(=O)[C@@H]2CCC[C@H]2C(O)=O)c1 \|r\|
BDBM20724	COc1ccc(NC(=O)Nc2ccc(cc2)-c2ccc(cc2)C(=O)[C@@H]2CCC[C@H]2C(O)=O)cc1 \|r\|
BDBM20725	OC(=O)[C@@H]1CCC[C@H]1C(=O)c1ccc(cc1)-c1ccc(NC(=O)Nc2ccc(cc2)C#N)cc1 \|r\|
BDBM20726	OC(=O)[C@@H]1CCC[C@H]1C(=O)c1ccc(cc1)-c1ccc(NC(=O)Nc2ccc(cc2)C(F)(F)F)cc1 \|r\|
BDBM20727	OC(=O)[C@@H]1CCC[C@H]1C(=O)c1ccc(cc1)-c1ccc(NC(=O)Nc2ccc3OCOc3c2)cc1 \|r\|
BDBM20728	OC(=O)[C@H]1CCC[C@@H]1C(=O)c1ccc(cc1)-c1ccc(NC(=O)Nc2ccccc2)cc1 \|r\|
BDBM20729	OC(=O)[C@H]1CCC[C@H]1C(=O)c1ccc(cc1)-c1ccc(NC(=O)Nc2ccccc2)cc1 \|r\|
BDBM20730	OC(=O)[C@@H]1CCC[C@H]1C(=O)c1ccc(cc1)-c1ccc(Nc2nc3ccc(OC(F)(F)F)cc3s2)c(F)c1 \|r\|
BDBM27947	CC1(C)Oc2ncnc(N)c2N=C1c1ccc(cc1)[C@H]1CC[C@H](CC(O)=O)CC1 \|r,wU:19.21,wD:22.25,c:12,(1.74,.99,;.97,2.32,;2.46,2.72,;-.37,1.55,;-1.7,2.32,;-3.03,1.55,;-4.37,2.32,;-4.37,3.86,;-3.03,4.63,;-3.03,6.17,;-1.7,3.86,;-.37,4.63,;.97,3.86,;2.3,4.63,;2.3,6.17,;3.63,6.94,;4.97,6.17,;4.97,4.63,;3.63,3.86,;6.19,6.75,;6.19,8.3,;7.53,9.07,;8.86,8.3,;10.19,9.07,;11.53,8.3,;12.86,9.07,;11.53,6.76,;8.86,6.75,;7.53,5.98,)\|
BDBM27949	CC1(C)Oc2ncnc(N)c2N=C1c1ccc(cc1)C12CCC(CC1)(CC2)C(O)=O \|c:12\|
BDBM27950	CC1(C)Oc2ncnc(N)c2N=C1c1ccc(cc1)C12CCC(CC(O)=O)(CC1)CC2 \|c:12\|
BDBM27951	CC(C(O)=O)C12CCC(CC1)(CC2)c1ccc(cc1)C1=Nc2c(N)ncnc2OC1(C)C \|t:22\|
BDBM27952	CC1(C)Oc2ncnc(N)c2N=C1c1ccc(cc1)C12CCC(CC(O)=O)(CC1)CCC2 \|c:12,(7.57,-6.87,;8.39,-5.6,;6.94,-5.51,;7.75,-4.15,;8.66,-2.98,;7.93,-1.62,;8.84,-.35,;10.38,-.44,;11.01,-1.8,;12.55,-1.98,;10.11,-3.07,;10.83,-4.42,;9.93,-5.69,;10.56,-7.05,;12.1,-7.23,;12.83,-8.59,;11.92,-9.86,;10.38,-9.77,;9.75,-8.32,;12.64,-11.22,;13.82,-12.03,;14.09,-13.39,;13.37,-14.66,;13.37,-16.2,;14.73,-16.93,;16,-16.2,;14.73,-18.47,;12.01,-13.94,;11.65,-12.49,;14.82,-13.94,;15.18,-12.4,;14.18,-11.22,)\|
BDBM27953	CC1(C)Oc2ncnc(N)c2N=C1c1ccc(cc1)C12CC3CC(CC(CC(O)=O)(C3)C1)C2 \|c:12,TLB:30:21:32:31.25.24,30:25:32:20.21.22,26:25:20:32.22.23,THB:24:25:20:32.22.23,24:23:20:31.30.25\|
BDBM27954	CC1(C)Oc2ncnc(N)c2N=C1c1ccc(cc1)C12CC3CC(CC(C3)(C1)C(O)=O)C2 \|c:12,TLB:26:21:31:27.25.24,26:25:31:20.21.22,28:25:20:31.22.23,THB:24:25:20:31.22.23,24:23:20:27.26.25\|
BDBM50003858	CC1(C)Oc2ncnc(N)c2N=C1c1ccc(cc1)-c1ccc(CC(O)=O)cc1 \|c:12\|
BDBM50005653	OC(=O)[C@H]1CC[C@@H](CC1)NC(=O)c1ncc(s1)-c1ccc(NC(=O)Nc2ccc(F)cc2F)cc1 \|r,wU:6.9,wD:3.2,(25.13,-47.8,;24.31,-49.11,;25.04,-50.47,;22.78,-49.06,;22.05,-47.71,;20.5,-47.66,;19.7,-48.97,;20.43,-50.33,;21.96,-50.37,;18.16,-48.93,;17.36,-50.24,;18.09,-51.59,;15.82,-50.2,;14.95,-48.93,;13.47,-49.36,;13.43,-50.9,;14.88,-51.42,;12.16,-51.78,;10.82,-51.01,;9.49,-51.78,;9.49,-53.33,;8.16,-54.1,;6.82,-53.33,;6.83,-51.79,;5.49,-54.09,;4.16,-53.32,;4.17,-51.78,;2.84,-51.01,;1.5,-51.78,;.17,-51.01,;1.5,-53.33,;2.84,-54.09,;2.84,-55.63,;10.83,-54.1,;12.16,-53.33,)\|
BDBM50005655	OC(=O)[C@H]1CC[C@@H](CC1)NC(=O)c1ncc(s1)-c1ccc(NC(=O)Nc2ccccc2)cc1 \|r,wU:6.9,wD:3.2,(71.08,-51.02,;70.26,-52.33,;70.99,-53.69,;68.73,-52.28,;68,-50.93,;66.45,-50.88,;65.65,-52.19,;66.38,-53.55,;67.91,-53.59,;64.11,-52.15,;63.31,-53.46,;64.04,-54.81,;61.77,-53.42,;60.9,-52.15,;59.42,-52.58,;59.38,-54.12,;60.83,-54.64,;58.11,-55,;56.77,-54.23,;55.44,-55,;55.44,-56.55,;54.11,-57.32,;52.77,-56.55,;52.78,-55.01,;51.44,-57.31,;50.11,-56.54,;50.12,-55,;48.79,-54.23,;47.45,-55,;47.45,-56.55,;48.79,-57.31,;56.78,-57.32,;58.11,-56.55,)\|
BDBM50005648	OC(=O)[C@H]1CC[C@@H](CC1)NC(=O)c1ncc(s1)-c1ccc(NC(=O)c2cc(F)cc(F)c2)cc1 \|r,wU:6.9,wD:3.2,(51.34,-23.3,;50.53,-24.61,;51.25,-25.96,;48.99,-24.56,;48.26,-23.2,;46.71,-23.15,;45.91,-24.46,;46.64,-25.82,;48.17,-25.87,;44.37,-24.42,;43.57,-25.73,;44.3,-27.09,;42.03,-25.69,;41.16,-24.42,;39.68,-24.86,;39.64,-26.39,;41.09,-26.91,;38.37,-27.27,;37.03,-26.51,;35.7,-27.28,;35.7,-28.82,;34.37,-29.59,;33.03,-28.82,;33.04,-27.28,;31.7,-29.59,;31.7,-31.12,;30.38,-31.89,;30.38,-33.43,;29.03,-31.12,;29.04,-29.58,;27.7,-28.81,;30.37,-28.81,;37.04,-29.59,;38.37,-28.82,)\|
BDBM50005650	COc1ccccc1NC(=O)Nc1ccc(cc1)-c1cnc(s1)C(=O)N[C@H]1CC[C@@H](CC1)C(O)=O \|r,wU:26.28,wD:29.35,(1.32,-43.95,;2.65,-43.18,;2.64,-41.64,;1.31,-40.88,;1.31,-39.33,;2.64,-38.56,;3.97,-39.33,;3.96,-40.87,;5.3,-41.64,;6.63,-40.87,;6.63,-39.33,;7.96,-41.64,;9.3,-40.88,;9.3,-39.33,;10.63,-38.56,;11.96,-39.32,;11.97,-40.87,;10.63,-41.65,;13.23,-38.45,;13.28,-36.91,;14.75,-36.47,;15.62,-37.75,;14.68,-38.97,;17.16,-37.79,;17.9,-39.14,;17.97,-36.48,;19.51,-36.52,;20.31,-35.21,;21.85,-35.26,;22.58,-36.61,;21.77,-37.92,;20.23,-37.88,;24.12,-36.66,;24.93,-35.35,;24.85,-38.02,)\|
BDBM50005651	OC(=O)[C@H]1CC[C@@H](CC1)NC(=O)c1ncc(s1)-c1ccc(NC(=O)Nc2ccccc2F)cc1 \|r,wU:6.9,wD:3.2,(47.51,-36.67,;46.7,-37.98,;47.43,-39.33,;45.16,-37.93,;44.43,-36.57,;42.89,-36.52,;42.09,-37.83,;42.81,-39.19,;44.35,-39.24,;40.55,-37.79,;39.74,-39.1,;40.47,-40.46,;38.2,-39.06,;37.33,-37.79,;35.85,-38.22,;35.81,-39.76,;37.26,-40.28,;34.54,-40.64,;33.21,-39.88,;31.88,-40.65,;31.88,-42.19,;30.54,-42.96,;29.21,-42.19,;29.21,-40.65,;27.87,-42.96,;26.54,-42.19,;26.55,-40.64,;25.22,-39.87,;23.88,-40.64,;23.89,-42.19,;25.22,-42.95,;25.22,-44.49,;33.21,-42.96,;34.55,-42.19,)\|
BDBM50003857	CC1(C)Oc2ncnc(N)c2N=C1c1ccc(cc1)[C@H]1CC[C@H](CCC(O)=O)CC1 \|r,wU:19.21,wD:22.25,c:12,(25.63,-58.39,;24.09,-58.39,;24.86,-59.72,;22.76,-59.17,;21.42,-58.4,;20.09,-59.18,;18.75,-58.41,;18.76,-56.86,;20.09,-56.09,;20.08,-54.55,;21.42,-56.86,;22.75,-56.08,;24.08,-56.84,;25.41,-56.06,;26.75,-56.83,;28.07,-56.06,;28.07,-54.51,;26.72,-53.75,;25.4,-54.53,;29.39,-53.73,;29.37,-52.2,;30.71,-51.42,;32.05,-52.18,;33.38,-51.41,;34.71,-52.17,;34.72,-53.71,;33.39,-54.49,;36.06,-54.48,;32.05,-53.72,;30.73,-54.5,)\|
BDBM50003860	CC1(C)Oc2nc(nc(N)c2N=C1c1ccc(cc1)[C@H]1CC[C@H](CC(O)=O)CC1)C(F)(F)F \|r,wU:19.21,wD:22.25,c:12,(27.64,-8.52,;26.1,-8.52,;26.87,-9.85,;24.77,-9.3,;23.44,-8.53,;22.1,-9.31,;20.77,-8.54,;20.77,-6.99,;22.1,-6.22,;22.1,-4.68,;23.44,-6.99,;24.76,-6.21,;26.1,-6.97,;27.43,-6.19,;28.76,-6.96,;30.09,-6.19,;30.08,-4.64,;28.73,-3.88,;27.41,-4.66,;31.41,-3.86,;31.39,-2.32,;32.72,-1.55,;34.06,-2.31,;35.39,-1.54,;36.73,-2.3,;36.74,-3.84,;38.06,-1.53,;34.06,-3.85,;32.74,-4.63,;19.44,-9.31,;18.1,-8.53,;19.43,-10.85,;18.09,-10.06,)\|
BDBM50003716	Cc1nc(N)c2N=C(COc2n1)c1ccc(Br)cc1 \|c:6\|
BDBM50003718	CN(C)c1nc(N)c2N=C(COc2n1)c1ccc(Br)cc1 \|c:8\|
BDBM50003720	CNc1ncnc2OCC(=Nc12)c1ccc(Br)cc1 \|c:9\|
BDBM50003819	CC1(C)Oc2ncnc(N)c2N=C1c1ccc(O)cc1 \|c:12\|
BDBM50003848	CC1(C)Oc2ncnc(N)c2N=C1c1ccc(cc1)N1CCCCC1 \|c:12\|
BDBM50003850	CC(C)(C(O)=O)c1ccc(cc1)C1=Nc2c(N)ncnc2OC1(C)C \|t:13\|
BDBM50003725	Nc1ncnc2OCC(Nc12)c1ccc(Br)cc1
BDBM50003722	Nc1cccc2OCC(=Nc12)c1ccc(Br)cc1 \|c:8\|
BDBM50003723	CC1Oc2ncnc(N)c2N=C1c1ccc(Br)cc1 \|c:11\|
BDBM50003727	CC1(C)Oc2ncnc(N)c2NC1c1ccc(Br)cc1
BDBM50003854	CC1(C)Oc2ncnc(N)c2N=C1c1ccc(cc1)[C@H]1CC[C@H](O)CC1 \|r,wU:19.21,wD:22.25,c:12,(47.9,-48.52,;46.36,-48.52,;47.13,-49.85,;45.03,-49.3,;43.69,-48.53,;42.36,-49.31,;41.02,-48.54,;41.03,-46.99,;42.35,-46.22,;42.35,-44.68,;43.69,-46.99,;45.02,-46.21,;46.35,-46.97,;47.68,-46.2,;49.01,-46.96,;50.34,-46.19,;50.33,-44.65,;48.99,-43.88,;47.66,-44.67,;51.66,-43.87,;51.64,-42.33,;52.98,-41.55,;54.31,-42.31,;55.65,-41.54,;54.32,-43.85,;52.99,-44.63,)\|
BDBM50003855	CC1(C)Oc2ncnc(N)c2N=C1c1ccc(cc1)C1CCC(F)(F)CC1 \|c:12\|
BDBM50003861	CC1(C)Oc2ncnc(N)c2N=C1c1ccc(cc1)[C@H]1CC[C@H](CC(N)=O)CC1 \|r,wU:19.21,wD:22.25,c:12,(42.45,-9.21,;40.91,-9.21,;41.68,-10.54,;39.58,-9.99,;38.25,-9.22,;36.91,-10,;35.58,-9.23,;35.58,-7.68,;36.91,-6.91,;36.9,-5.37,;38.24,-7.68,;39.57,-6.9,;40.91,-7.66,;42.24,-6.89,;43.57,-7.65,;44.9,-6.88,;44.89,-5.34,;43.54,-4.58,;42.22,-5.36,;46.22,-4.56,;46.19,-3.02,;47.53,-2.24,;48.87,-3,;50.2,-2.23,;51.54,-2.99,;51.55,-4.53,;52.87,-2.22,;48.87,-4.55,;47.55,-5.32,)\|
BDBM50003862	CC1(C)Oc2ncnc(N)c2N=C1c1ccc(cc1)[C@H]1CC[C@H](Cc2nnn[nH]2)CC1 \|r,wU:19.21,wD:22.25,c:12,(58.66,-9.38,;57.12,-9.38,;57.89,-10.71,;55.79,-10.16,;54.46,-9.39,;53.12,-10.17,;51.79,-9.4,;51.79,-7.86,;53.12,-7.08,;53.11,-5.54,;54.45,-7.85,;55.78,-7.08,;57.12,-7.84,;58.45,-7.06,;59.78,-7.83,;61.11,-7.05,;61.1,-5.51,;59.75,-4.75,;58.43,-5.53,;62.43,-4.73,;62.4,-3.19,;63.74,-2.41,;65.08,-3.18,;66.41,-2.4,;67.75,-3.17,;69.14,-2.53,;70.18,-3.67,;69.41,-5.01,;67.9,-4.7,;65.08,-4.72,;63.76,-5.49,)\|
BDBM50003714	Cc1nc(N)c2C=C(c3ccc(cc3)[C@H]3CC[C@H](CC(O)=O)CC3)C(C)(C)Oc2n1 \|r,wU:14.14,wD:17.18,t:6,(.07,-32.77,;1.4,-32,;1.41,-30.46,;2.73,-29.69,;2.73,-28.15,;4.07,-30.45,;5.4,-29.68,;6.73,-30.44,;8.06,-29.66,;9.39,-30.43,;10.72,-29.65,;10.71,-28.11,;9.37,-27.35,;8.04,-28.13,;12.04,-27.33,;12.02,-25.79,;13.35,-25.01,;14.69,-25.78,;16.02,-25,;17.36,-25.77,;17.37,-27.31,;18.7,-24.99,;14.7,-27.32,;13.37,-28.09,;6.74,-31.98,;8.28,-31.98,;7.51,-33.32,;5.41,-32.76,;4.07,-31.99,;2.74,-32.77,)\|
BDBM50003731	Cc1ccc(cc1)C1=Nc2c(N)ncnc2OC1(C)C \|t:8\|
BDBM50003733	CCCc1ccc(cc1)C1=Nc2c(N)ncnc2OC1(C)C \|t:10\|
BDBM50003729	CC1(C)Oc2ncnc(N)c2N=C1c1ccc(Cl)cc1 \|c:12\|
BDBM50003734	CCCCc1ccc(cc1)C1=Nc2c(N)ncnc2OC1(C)C \|t:11\|
BDBM50003812	CC1(C)Oc2ncnc(N)c2N=C1c1ccc(cc1)-c1ccccc1 \|c:12\|
BDBM50003815	CC1(C)Oc2nc(nc(N)c2N=C1c1ccc2c(CC[C@@]22CC[C@H](CC(O)=O)CC2)c1)C(F)(F)F \|r,wU:20.22,wD:23.26,c:12,(27.23,-21.22,;25.69,-21.22,;26.46,-22.55,;24.36,-22,;23.03,-21.23,;21.69,-22.01,;20.36,-21.24,;20.36,-19.69,;21.69,-18.92,;21.68,-17.38,;23.02,-19.69,;24.35,-18.91,;25.69,-19.67,;27.02,-18.9,;27,-17.37,;28.32,-16.58,;29.67,-17.35,;29.68,-18.88,;31.15,-19.35,;32.04,-18.1,;31.12,-16.86,;30.02,-15.78,;30.42,-14.29,;31.91,-13.88,;32.3,-12.39,;33.79,-11.99,;34.89,-13.08,;34.19,-10.5,;33,-14.97,;32.61,-16.45,;28.35,-19.66,;19.02,-22.01,;17.69,-21.24,;19.02,-23.55,;17.68,-22.77,)\|
BDBM50003736	CC(C)(C)c1ccc(cc1)C1=Nc2c(N)ncnc2OC1(C)C \|t:11\|
BDBM50005649	OC(=O)[C@H]1CC[C@@H](CC1)NC(=O)c1ncc(s1)-c1ccc(NC(=O)Nc2cc(F)cc(F)c2)cc1 \|r,wU:6.9,wD:3.2,(47.51,-36.67,;46.7,-37.98,;47.43,-39.33,;45.16,-37.93,;44.43,-36.57,;42.89,-36.52,;42.09,-37.83,;42.81,-39.19,;44.35,-39.24,;40.55,-37.79,;39.74,-39.1,;40.47,-40.46,;38.2,-39.06,;37.33,-37.79,;35.85,-38.22,;35.81,-39.76,;37.26,-40.28,;34.54,-40.64,;33.21,-39.88,;31.88,-40.65,;31.88,-42.19,;30.54,-42.96,;29.21,-42.19,;29.21,-40.65,;27.87,-42.96,;26.54,-42.19,;25.22,-42.95,;23.89,-42.19,;22.54,-42.97,;23.88,-40.64,;25.22,-39.87,;25.22,-38.32,;26.55,-40.64,;33.21,-42.96,;34.55,-42.19,)\|
BDBM50005654	OC(=O)[C@H]1CC[C@@H](CC1)NC(=O)c1ncc(s1)-c1ccc(NC(=O)Nc2cc(F)c(F)cc2F)cc1 \|r,wU:6.9,wD:3.2,(48.29,-50.11,;47.48,-51.42,;48.2,-52.78,;45.94,-51.37,;45.21,-50.02,;43.66,-49.97,;42.86,-51.28,;43.59,-52.64,;45.12,-52.68,;41.33,-51.24,;40.52,-52.55,;41.25,-53.9,;38.98,-52.51,;38.11,-51.24,;36.63,-51.67,;36.59,-53.21,;38.04,-53.73,;35.32,-54.09,;33.98,-53.32,;32.66,-54.09,;32.65,-55.64,;31.32,-56.41,;29.99,-55.64,;29.99,-54.1,;28.65,-56.4,;27.32,-55.63,;27.33,-54.09,;26,-53.32,;26,-51.78,;24.66,-54.09,;23.33,-53.32,;24.67,-55.64,;26,-56.4,;26,-57.94,;33.99,-56.41,;35.32,-55.64,)\|
BDBM50005647	OC(=O)[C@H]1CC[C@@H](CC1)NC(=O)c1ncc(s1)-c1ccc(NC(=O)c2nc(oc2C(F)(F)F)-c2ccccc2)cc1 \|r,wU:6.9,wD:3.2,(28.27,-23.6,;27.46,-24.91,;28.18,-26.27,;25.92,-24.86,;25.19,-23.5,;23.64,-23.45,;22.84,-24.77,;23.57,-26.12,;25.1,-26.17,;21.31,-24.72,;20.5,-26.04,;21.23,-27.39,;18.96,-25.99,;18.09,-24.72,;16.61,-25.16,;16.57,-26.7,;18.02,-27.21,;15.3,-27.57,;13.96,-26.81,;12.64,-27.58,;12.63,-29.12,;11.3,-29.89,;9.97,-29.12,;9.97,-27.58,;8.51,-29.61,;7.25,-28.72,;6.01,-29.63,;6.5,-31.09,;8.04,-31.08,;8.96,-32.32,;8.34,-33.73,;10.49,-32.14,;9.71,-33.65,;4.55,-29.18,;4.22,-27.67,;2.75,-27.21,;1.61,-28.25,;1.95,-29.76,;3.42,-30.21,;13.97,-29.89,;15.31,-29.12,)\|
BDBM50005652	OC(=O)[C@H]1CC[C@@H](CC1)NC(=O)c1ncc(s1)-c1ccc(NC(=O)Nc2ccccc2Cl)cc1 \|r,wU:6.9,wD:3.2,(70.47,-38.11,;69.66,-39.41,;70.39,-40.77,;68.12,-39.37,;67.39,-38.01,;65.84,-37.96,;65.05,-39.27,;65.77,-40.63,;67.3,-40.67,;63.51,-39.23,;62.7,-40.54,;63.43,-41.9,;61.16,-40.5,;60.29,-39.23,;58.81,-39.66,;58.77,-41.2,;60.22,-41.72,;57.5,-42.08,;56.17,-41.31,;54.84,-42.08,;54.83,-43.63,;53.5,-44.4,;52.17,-43.63,;52.17,-42.09,;50.83,-44.4,;49.5,-43.62,;49.51,-42.08,;48.18,-41.31,;46.84,-42.08,;46.85,-43.63,;48.18,-44.39,;48.18,-45.93,;56.17,-44.4,;57.51,-43.63,)\|
BDBM113711	OC(=O)C1CCC(CC1)Oc1ccc(cn1)-c1ccc2N(CCOc2c1)C(=O)Nc1ccccc1 \|(10.67,1.54,;9.34,.77,;9.34,-.77,;8,1.54,;6.67,.77,;5.33,1.54,;5.33,3.08,;6.67,3.85,;8,3.08,;4,3.85,;2.67,3.08,;2.67,1.54,;1.33,.77,;,1.54,;,3.08,;1.33,3.85,;-1.33,.77,;-1.33,-.77,;-2.67,-1.54,;-4,-.77,;-5.33,-1.54,;-6.67,-.77,;-6.67,.77,;-5.33,1.54,;-4,.77,;-2.67,1.54,;-5.33,-3.08,;-4,-3.85,;-6.67,-3.85,;-8,-3.08,;-8,-1.54,;-9.34,-.77,;-10.67,-1.54,;-10.67,-3.08,;-9.34,-3.85,)\|
BDBM113712	CC1CN(C(=O)Nc2ccccc2)c2ccc(cc2O1)-c1ccc(OC2CCC(CC2)C(O)=O)nc1 \|(-8,1.54,;-6.67,.77,;-6.67,-.77,;-5.33,-1.54,;-5.33,-3.08,;-4,-3.85,;-6.67,-3.85,;-8,-3.08,;-8,-1.54,;-9.34,-.77,;-10.67,-1.54,;-10.67,-3.08,;-9.34,-3.85,;-4,-.77,;-2.67,-1.54,;-1.33,-.77,;-1.33,.77,;-2.67,1.54,;-4,.77,;-5.33,1.54,;,1.54,;1.33,.77,;2.67,1.54,;2.67,3.08,;4,3.85,;5.33,3.08,;5.33,1.54,;6.67,.77,;8,1.54,;8,3.08,;6.67,3.85,;9.34,.77,;10.67,1.54,;9.34,-.77,;1.33,3.85,;,3.08,)\|
BDBM113713	CCC1CN(C(=O)Nc2ccccc2)c2ccc(cc2O1)-c1ccc(OC2CCC(CC2)C(O)=O)nc1 \|(-9.34,.77,;-8,1.54,;-6.67,.77,;-6.67,-.77,;-5.33,-1.54,;-5.33,-3.08,;-4,-3.85,;-6.67,-3.85,;-8,-3.08,;-8,-1.54,;-9.34,-.77,;-10.67,-1.54,;-10.67,-3.08,;-9.34,-3.85,;-4,-.77,;-2.67,-1.54,;-1.33,-.77,;-1.33,.77,;-2.67,1.54,;-4,.77,;-5.33,1.54,;,1.54,;1.33,.77,;2.67,1.54,;2.67,3.08,;4,3.85,;5.33,3.08,;5.33,1.54,;6.67,.77,;8,1.54,;8,3.08,;6.67,3.85,;9.34,.77,;10.67,1.54,;9.34,-.77,;1.33,3.85,;,3.08,)\|
BDBM113715	CCc1ccccc1NC(=O)N1CCOc2cc(ccc12)-c1ccc(OC2CCC(CC2)C(O)=O)nc1 \|(-8,-5,;-9.34,-4.23,;-9.34,-2.69,;-10.67,-1.93,;-10.67,-.38,;-9.34,.38,;-8,-.38,;-8,-1.93,;-6.67,-2.69,;-5.33,-1.93,;-4,-2.69,;-5.33,-.38,;-6.67,.38,;-6.67,1.93,;-5.33,2.69,;-4,1.93,;-2.67,2.69,;-1.33,1.93,;-1.33,.38,;-2.67,-.38,;-4,.38,;,2.69,;1.33,1.93,;2.67,2.69,;2.67,4.23,;4,5,;5.33,4.23,;5.33,2.69,;6.67,1.93,;8,2.69,;8,4.23,;6.67,5,;9.34,1.93,;10.67,2.69,;9.34,.38,;1.33,5,;,4.23,)\|
BDBM113716	OC(=O)C1CCC(CC1)Oc1ccc(cn1)-c1ccc2N(CCOc2c1)C(=O)Nc1ccc(F)cc1C(F)(F)F \|(11.34,3.08,;10,2.31,;10,.77,;8.67,3.08,;7.34,2.31,;6,3.08,;6,4.62,;7.34,5.39,;8.67,4.62,;4.67,5.39,;3.33,4.62,;3.33,3.08,;2,2.31,;.67,3.08,;.67,4.62,;2,5.39,;-.67,2.31,;-.67,.77,;-2,,;-3.33,.77,;-4.67,,;-6,.77,;-6,2.31,;-4.67,3.08,;-3.33,2.31,;-2,3.08,;-4.67,-1.54,;-3.33,-2.31,;-6,-2.31,;-7.34,-1.54,;-7.34,,;-8.67,.77,;-10,,;-11.34,.77,;-10,-1.54,;-8.67,-2.31,;-8.67,-3.85,;-8.67,-5.39,;-7.13,-3.85,;-10.21,-3.85,)\|
BDBM113717	CC(C)(COc1ccc(cn1)-c1ccc2N(CCOc2c1)C(=O)Nc1ccccc1)C(O)=O
BDBM113718	CC1CN(C(=O)Nc2ccccc2)c2ccc(cc2O1)-c1ccc(OCC(C)(C)C(O)=O)nc1
BDBM113719	CCC1CN(C(=O)Nc2ccccc2)c2ccc(cc2O1)-c1ccc(OCC(C)(C)C(O)=O)nc1
BDBM113720	CCC1CN(C(=O)Nc2ccc(Cl)cc2F)c2ccc(cc2O1)-c1ccc(OCC(C)(C)C(O)=O)nc1
BDBM113721	CC1CN(C(=O)Nc2ccc(F)c(Cl)c2)c2ccc(cc2O1)-c1ccc(OCC(C)(C)C(O)=O)nc1
BDBM113722	CCCc1ccccc1NC(=O)c1cc(C)nc2cc(ccc12)-c1ccc(OCC(C)(C)C(O)=O)nc1
BDBM113723	Cc1cc(C(=O)Nc2ccccc2)c2ccc(cc2n1)-c1ccc(OCC(C)(C)C(O)=O)nc1
BDBM113724	CCCCCCNC(=O)N1CC(C)Oc2cc(ccc12)-c1ccc(OCC(C)(C)C(O)=O)nc1
BDBM113725	C[C@@H]1CN(C(=O)Nc2ccc(Cl)cc2F)c2ccc(cc2O1)-c1ccc(OCC(C)(C)C(O)=O)nc1 \|r\|
BDBM161377	Cc1nc(C(=O)Nc2ccc(cc2)-c2ccc(cc2)C2CCC(CC(O)=O)OC2)c(o1)C(F)(F)F
BDBM161384	OC(=O)CC1CCC(OC1)c1ccc(cc1)-c1ccc(Nc2nnc(o2)C2CCC2)cc1
BDBM50208612	[#6]-[#8]-c1cc(-[#8])c(-[#6]-[#6](-[#6]\[#6]=[#6](\[#6])-[#6])-[#6](-[#6])=[#6])c2-[#8]-[#6@@H](-[#6]-[#6](=O)-c12)-c1ccc(-[#8])cc1-[#8] \|r\|
BDBM161383	[O-]C(=O)CC1CCC(OC1)c1ccc(cc1)-c1ccc(Nc2nnc(o2)C2CCC2)cc1
BDBM161382	OC(=O)CC1CCC(CO1)c1ccc(cc1)-c1ccc(Nc2nnc(o2)C2CCC2)cc1
BDBM50314730	CCOc1ccc(cc1)C(=O)NCCNC(=O)c1cn(nc1C(F)(F)F)-c1ccccc1
BDBM50314731	CCOc1ccc(cc1)C(=O)NCCNC(=O)c1nn(cc1C)-c1ccccc1
BDBM50314732	CCOc1ccc(cc1)C(=O)NCCNC(=O)c1cn(nc1C)-c1ccccc1
BDBM50314733	CCOc1ccc(cc1)C(=O)NCCNC(=O)c1cn(nc1C(F)(F)F)C1CCCCC1
BDBM50314734	CCOc1ccc(cc1)C(=O)NCCNC(=O)c1cn(nc1C(F)(F)F)-c1ccc(Cl)cc1
BDBM50314735	CCOc1ccc(cc1)C(=O)NCCNC(=O)c1cn(Cc2ccccc2)nc1C(F)(F)F
BDBM50314736	CCOc1ccc(cc1)C(=O)NCCNC(=O)c1cn(nc1C(F)(F)F)-c1ccc(OCC)cc1
BDBM50314737	CCOc1ccc(cc1)C(=O)NCCNC(=O)c1cn(nc1C(F)(F)F)-c1cccc(OCC)c1
BDBM50314738	CCOc1ccc(cc1)C(=O)NCCNC(=O)c1cn(nc1C(F)(F)F)-c1ccccn1
BDBM50314739	CCOc1ccc(cc1)C(=O)NCCNC(=O)c1cn(nc1C(F)(F)F)-c1ccncc1
BDBM50314740	CCOc1ccc(cc1)C(=O)NCCNC(=O)c1cn(nc1C(F)(F)F)-c1cccnc1
BDBM50314741	CCOc1ccc(cc1)C(=O)NCCNC(=O)c1cn(nc1C(F)(F)F)-c1ccccc1O
BDBM50314742	CCOc1ccc(cc1)C(=O)N[C@@H](CO)CNC(=O)c1cn(nc1C(F)(F)F)-c1ccccc1 \|r\|
BDBM50314743	CCOc1ccc(cc1)C(=O)N[C@H](CO)CNC(=O)c1cn(nc1C(F)(F)F)-c1ccccc1 \|r\|
BDBM50314744	CCOc1ccc(cc1)C(=O)NC[C@@H](CO)NC(=O)c1cn(nc1C(F)(F)F)-c1ccccc1 \|r\|
BDBM50314745	CCOc1ccc(cc1)C(=O)NC[C@H](CO)NC(=O)c1cn(nc1C(F)(F)F)-c1ccccc1 \|r\|
BDBM50314746	CCOc1ccc(cc1)C(=O)NCC(C)NC(=O)c1cn(nc1C(F)(F)F)-c1ccccc1
BDBM50314747	CCOc1ccc(cc1)C(=O)NC(C)CNC(=O)c1cn(nc1C(F)(F)F)-c1ccccc1
BDBM50314748	CCOc1cccc(c1)C(=O)NCCNC(=O)c1cn(nc1C(F)(F)F)-c1ccccc1
BDBM50314749	FC(F)(F)c1nn(cc1C(=O)NCCNC(=O)c1ccc(cc1)-n1cccn1)-c1ccccc1
BDBM50314750	FC(F)(F)c1nn(cc1C(=O)NCCNC(=O)c1ccc(Cl)cn1)-c1ccccc1
BDBM50314751	FC(F)(F)c1nn(cc1C(=O)NCCNC(=O)c1ccc(Cl)nc1)-c1ccccc1
BDBM50314752	FC(F)(F)COc1ccc(cn1)C(=O)NCCNC(=O)c1cn(nc1C(F)(F)F)-c1ccccc1
BDBM50314753	CCOc1ccc(cn1)C(=O)NCCNC(=O)c1cn(nc1C(F)(F)F)-c1ccccc1
BDBM50314754	CCOc1cc(C)c(cc1OCC)C(=O)CCC(=O)Nc1nc(c(Cc2ccccc2)s1)-c1ccccc1
BDBM50314755	CCOc1ccc(cc1)C(=O)NCCNC(=O)c1nc(c(Cc2ccccc2)s1)-c1ccccc1
BDBM50328341	CCCc1c(C(=O)OCC)c(C(=O)OCC)c2c(cc(nn12)N1CCOCC1)-c1ccccc1
BDBM50328342	CCOC(=O)c1c(C(=O)OCC)c2c(cc(nn2c1-c1ccc(OC)cc1)N1CCOCC1)-c1ccccc1
BDBM50328343	CCOC(=O)c1c(C(=O)OCC)c2c(cc(nn2c1-c1ccc(OCc2ccccc2)cc1)N1CCOCC1)-c1ccccc1
BDBM50328344	CCOC(=O)c1c(C(=O)OCC)c2c(cc(nn2c1-c1ccc(Cl)cc1)N1CCOCC1)-c1ccccc1
BDBM50328345	CCOC(=O)c1c(CC=C)n2nc(cc(-c3ccccc3)c2c1C(=O)OCC)N1CCOCC1
BDBM50328346	CCOC(=O)c1c(C(=O)OCC)c2c(cc(nn2c1-c1ccccc1)N1CCOCC1)-c1ccccc1
BDBM50328347	CCOC(=O)c1c(CCC(F)(F)F)n2nc(cc(-c3ccccc3)c2c1C(=O)OCC)N1CCOCC1
BDBM50328348	CCCCc1c(C(=O)OCC)c(C(=O)OCC)c2c(cc(nn12)N1CCOCC1)-c1ccccc1
BDBM50328349	CCCCCc1c(C(=O)OCC)c(C(=O)OCC)c2c(cc(nn12)N1CCOCC1)-c1ccccc1
BDBM50328350	CCOC(=O)c1c(CC)n2nc(cc(-c3ccccc3)c2c1C(=O)OCC)N1CCOCC1
BDBM50328351	CCOC(=O)c1c(COC)n2nc(cc(-c3ccccc3)c2c1C(=O)OCC)N1CCOCC1
BDBM50328352	CCOC(=O)c1c(C(=O)OCC)c2c(cc(nn2c1-c1ccc(cc1)-c1ccccc1)N1CCOCC1)-c1ccccc1
BDBM50328353	CCOC(=O)c1c(CCCOC)n2nc(cc(-c3ccccc3)c2c1C(=O)OCC)N1CCOCC1
BDBM50328354	CCOC(=O)c1c(C(=O)OCC)c2c(cc(nn2c1-c1cccc(Cl)c1)N1CCOCC1)-c1ccccc1
BDBM50328355	CCOC(=O)c1c(C(=O)OCC)c2c(cc(nn2c1-c1cccc(OC)c1)N1CCOCC1)-c1ccccc1
BDBM50328356	CCOC(=O)c1c(C)n2nc(cc(-c3ccccc3)c2c1C(=O)OCC)N1CCOCC1
BDBM50328357	CCOC(=O)c1c(C(=O)OCC)c2c(cc(nn2c1-c1ccc(O)cc1)N1CCOCC1)-c1ccccc1
BDBM50328358	CCOC(=O)c1c(C(=O)OCC)c2c(cc(nn2c1C1CC1)N1CCOCC1)-c1ccccc1
BDBM50328359	CCOC(=O)c1c(C(=O)OCC)c2c(cc(nn2c1-c1ccc(N)cc1)N1CCOCC1)-c1ccccc1
BDBM50328360	CCOC(=O)c1c(C(=O)OCC)c2c(cc(nn2c1C1CCC1)N1CCOCC1)-c1ccccc1
BDBM50328361	CCOC(=O)c1c(CCCN(C)C)n2nc(cc(-c3ccccc3)c2c1C(=O)OCC)N1CCOCC1
BDBM50328362	CCOC(=O)c1c(CCCO)n2nc(cc(-c3ccccc3)c2c1C(=O)OCC)N1CCOCC1
BDBM50328363	CCOC(=O)c1cn2nc(cc(-c3ccccc3)c2c1C(=O)OCC)N1CCOCC1
BDBM50328364	CCCc1c(C(=O)OCC)c(C(=O)OCC)c2c(cc(nn12)N1C[C@H](C)O[C@H](C)C1)-c1ccccc1 \|r\|
BDBM50328365	CCCc1c(C(=O)OCC)c(C(=O)OCC)c2c(cc(nn12)N1CCC1)-c1ccccc1
BDBM50328366	CCCc1c(C(=O)OCC)c(C(=O)OCC)c2c(cc(nn12)N1CCCC1)-c1ccccc1
BDBM50328367	CCCc1c(C(=O)OCC)c(C(=O)OCC)c2c(cc(nn12)N1CCCCC1)-c1ccccc1
BDBM50328368	CCCc1c(C(=O)OCC)c(C(=O)OCC)c2c(cc(nn12)N(C)C)-c1ccccc1
BDBM50328369	CCCc1c(C(=O)OCC)c(C(=O)OCC)c2c(cc(nn12)N1CCOCC1)-c1ccccc1F
BDBM50328370	CCCc1c(C(=O)OCC)c(C(=O)OCC)c2c(cc(nn12)N1CCOCC1)-c1cccc(F)c1
BDBM50328371	CCCc1c(C(=O)OCC)c(C(=O)OCC)c2c(cc(nn12)N1CCOCC1)-c1ccc(F)cc1
BDBM50328372	CCCc1c(C(=O)OCC)c(C(=O)OCC)c2c(CCC)cc(nn12)N1CCOCC1
BDBM50328373	CCCc1c(C(=O)OCC)c(C(=O)OCC)c2c(cc(nn12)N1CCOCC1)C(C)(C)C
BDBM50328374	CCCc1c(C(=O)OCC)c(C(=O)OCC)c2c(cc(nn12)N1CCOCC1)C1CCC1
BDBM50328375	CCCc1c(C(=O)OCC)c(C(=O)OCC)c2c(cc(nn12)N1CCOCC1)C1CCCC1
BDBM50328376	CCCc1c(C(=O)OCC)c(C(=O)OCC)c2c(cc(nn12)N1CCOCC1)C1CCCCC1
BDBM50328377	CCCc1c(-c2nc(no2)C(C)(C)C)c(C(=O)OCC)c2c(cc(nn12)N1CCOCC1)-c1ccccc1
BDBM50328378	CCCc1c(-c2nc(no2)C2CCCC2)c(C(=O)OCC)c2c(cc(nn12)N1CCOCC1)-c1ccccc1
BDBM50328379	CCCc1c(-c2nc(no2)C2CCCCC2)c(C(=O)OCC)c2c(cc(nn12)N1CCOCC1)-c1ccccc1
BDBM50328380	CCCc1c(-c2nc(no2)C(C)C)c(C(=O)OCC)c2c(cc(nn12)N1CCOCC1)-c1ccccc1
BDBM50328381	CCCc1noc(n1)-c1c(CCC)n2nc(cc(-c3ccccc3)c2c1C(=O)OCC)N1CCOCC1
BDBM50328382	CCCCc1noc(n1)-c1c(CCC)n2nc(cc(-c3ccccc3)c2c1C(=O)OCC)N1CCOCC1
BDBM50328383	CCCc1c(-c2nc(Cc3ccccc3)no2)c(C(=O)OCC)c2c(cc(nn12)N1CCOCC1)-c1ccccc1
BDBM50328384	CCCc1c(-c2nc(no2)N2CCCC2)c(C(=O)OCC)c2c(cc(nn12)N1CCOCC1)-c1ccccc1
BDBM50328385	CCCc1c(-c2nc(CC)no2)c(C(=O)OCC)c2c(cc(nn12)N1CCOCC1)-c1ccccc1
BDBM50328386	CCCCCc1noc(n1)-c1c(CCC)n2nc(cc(-c3ccccc3)c2c1C(=O)OCC)N1CCOCC1
BDBM50328387	CCCc1c(-c2nc(no2)N(C)C)c(C(=O)OCC)c2c(cc(nn12)N1CCOCC1)-c1ccccc1
BDBM50328388	CCCc1c(-c2nc(no2)-c2ccccc2)c(C(=O)OCC)c2c(cc(nn12)N1CCOCC1)-c1ccccc1
BDBM50328389	CCOC(=O)c1c(c(CCO)n2nc(cc(-c3ccccc3)c12)N1CCOCC1)-c1nc(CCO)no1
BDBM50328390	CCCc1c(-c2nc(C)no2)c(C(=O)OCC)c2c(cc(nn12)N1CCOCC1)-c1ccccc1
BDBM50328391	CCCc1c(C(=O)OCC)c(C(=O)OCC)c2c(nc(nn12)N1CCOCC1)-c1ccccc1
BDBM50331629	Cc1ccc(cc1NC(=O)c1cnn(c1N)-c1ccccc1F)C(=O)Nc1ccon1
BDBM50341759	COCCN(C)c1ccc(NC(=O)c2nc(C)oc2C(F)(F)F)cn1
BDBM50341760	COCCN(C)c1ccc(NC(=O)c2nc(oc2C(F)(F)F)-c2ccccc2)cn1
BDBM50341761	COCCN(C)c1ccc(cn1)N(C)C(=O)c1nc(oc1C(F)(F)F)-c1ccccc1
BDBM50341762	COCCN(C)c1ccc(NC(=O)c2nc(oc2C(F)(F)F)-c2ccccc2)cc1
BDBM50341763	COCCN(C)c1ncc(NC(=O)c2nc(oc2C(F)(F)F)-c2ccccc2)cn1
BDBM50341764	CCOC1CN(C1)c1ccc(NC(=O)c2nc(oc2C(F)(F)F)-c2ccccc2)cn1
BDBM50341765	O[C@H]1CCN(C1)c1ncc(NC(=O)c2nc(oc2C(F)(F)F)-c2ccccc2)cn1 \|r\|
BDBM50341766	FC(F)(F)c1oc(nc1C(=O)Nc1ccc(nc1)N1CC(F)(F)C1)-c1ccccc1
BDBM50341767	OC(=O)COC1CN(C1)c1ccc(NC(=O)c2nc(oc2C(F)(F)F)-c2ccccc2)cn1
BDBM50341768	COC(=O)N1CCN(CC1)c1ccc(NC(=O)c2nc(oc2C(F)(F)F)-c2ccccc2)cn1
BDBM50341769	FC(F)(F)c1oc(nc1C(=O)Nc1ccc(nc1)N1CCN(CC1)C(=O)C1CC1)-c1ccccc1
BDBM50341770	CCOC(=O)N1CCN(CC1)c1ccc(NC(=O)c2nc(oc2C(F)(F)F)-c2ccccc2)cn1
BDBM50341771	COC(=O)N1CCN(CC1)c1ncc(NC(=O)c2nc(oc2C(F)(F)F)-c2ccccc2)cn1
BDBM50341772	COC(=O)N1CCC(CC1)c1ccc(NC(=O)c2nc(oc2C(F)(F)F)-c2ccccc2)cn1
BDBM50341773	FC(F)(F)c1oc(nc1C(=O)Nc1ccc(nc1)C1CCN(CC1)C(=O)C1CC1)-c1ccccc1
BDBM50341774	COC(=O)N1CCN(CC1)c1ccc(NC(=O)c2nc(oc2C(F)(F)F)-c2ccccc2)cc1
BDBM50341775	FC(F)(F)c1oc(nc1C(=O)Nc1ccc(cc1)N1CCN(CC1)C(=O)C1CC1)-c1ccccc1
BDBM50341776	FC(F)(F)c1oc(nc1C(=O)Nc1ccc(cc1)C1CCN(CC1)C(=O)C1CC1)-c1ccccc1
BDBM50341777	COC(=O)N1CCC(CC1)c1ccc(NC(=O)c2nc(oc2C(F)(F)F)-c2ccccc2)cc1
BDBM50341778	OC(=O)[C@H]1CC[C@@H](CC1)C(=O)N1CCN(CC1)c1ccc(NC(=O)c2nc(oc2C(F)(F)F)-c2ccccc2)cn1 \|r,wU:6.9,wD:3.2,(20.61,-31.2,;19.27,-30.45,;19.25,-28.91,;17.95,-31.23,;16.6,-30.48,;15.28,-31.27,;15.31,-32.8,;16.65,-33.55,;17.96,-32.77,;13.99,-33.59,;14.01,-35.12,;12.65,-32.84,;11.32,-33.63,;9.99,-32.88,;9.97,-31.35,;11.27,-30.55,;12.62,-31.3,;8.62,-30.6,;8.6,-29.06,;7.25,-28.31,;5.92,-29.1,;4.57,-28.36,;3.27,-29.17,;3.32,-30.7,;1.9,-28.44,;.69,-29.39,;-.59,-28.53,;-.17,-27.05,;1.38,-26.98,;2.14,-25.65,;3.68,-25.64,;1.37,-24.32,;2.76,-24.25,;-1.94,-29.27,;-3.26,-28.47,;-4.61,-29.21,;-4.65,-30.75,;-3.32,-31.55,;-1.97,-30.81,;5.96,-30.65,;7.3,-31.4,)\|
BDBM50341779	OC(=O)[C@H]1CC[C@@H](CC1)C(=O)N1CCN(CC1)c1ccc(NC(=O)c2nc(oc2C(F)(F)F)-c2ccccc2)cc1 \|r,wU:6.9,wD:3.2,(20.61,-31.2,;19.27,-30.45,;19.25,-28.91,;17.95,-31.23,;16.6,-30.48,;15.28,-31.27,;15.31,-32.8,;16.65,-33.55,;17.96,-32.77,;13.99,-33.59,;14.01,-35.12,;12.65,-32.84,;11.32,-33.63,;9.99,-32.88,;9.97,-31.35,;11.27,-30.55,;12.62,-31.3,;8.62,-30.6,;7.3,-31.4,;5.96,-30.65,;5.92,-29.1,;4.57,-28.36,;3.27,-29.17,;3.32,-30.7,;1.9,-28.44,;.69,-29.39,;-.59,-28.53,;-.17,-27.05,;1.38,-26.98,;2.14,-25.65,;3.68,-25.64,;1.37,-24.32,;2.76,-24.25,;-1.94,-29.27,;-3.26,-28.47,;-4.61,-29.21,;-4.65,-30.75,;-3.32,-31.55,;-1.97,-30.81,;7.25,-28.31,;8.6,-29.06,)\|
BDBM50341780	OC(=O)[C@H]1CC[C@@H](CC1)C(=O)N1CCC(CC1)c1ccc(NC(=O)c2nc(oc2C(F)(F)F)-c2ccccc2)cn1 \|r,wU:6.9,wD:3.2,(20.62,-31.22,;19.28,-30.47,;19.26,-28.93,;17.96,-31.25,;16.61,-30.5,;15.28,-31.29,;15.32,-32.82,;16.65,-33.57,;17.97,-32.79,;14,-33.61,;14.02,-35.14,;12.65,-32.86,;11.33,-33.65,;9.99,-32.9,;9.97,-31.36,;11.28,-30.56,;12.63,-31.32,;8.63,-30.62,;8.6,-29.08,;7.25,-28.33,;5.93,-29.12,;4.58,-28.38,;3.27,-29.18,;3.32,-30.72,;1.91,-28.45,;.69,-29.41,;-.59,-28.55,;-.17,-27.06,;1.38,-27,;2.14,-25.66,;3.68,-25.66,;1.37,-24.34,;2.77,-24.26,;-1.94,-29.29,;-3.26,-28.48,;-4.61,-29.23,;-4.65,-30.76,;-3.33,-31.57,;-1.98,-30.83,;5.96,-30.66,;7.31,-31.41,)\|
BDBM50341781	OC(=O)[C@H]1CC[C@H](CC1)C(=O)N1CCN(CC1)c1ccc(NC(=O)c2nc(oc2C(F)(F)F)-c2ccccc2)cc1 \|r,wU:6.9,3.2,(20.61,-31.2,;19.27,-30.45,;19.25,-28.91,;17.95,-31.23,;17.96,-32.77,;16.65,-33.55,;15.31,-32.8,;15.28,-31.27,;16.6,-30.48,;13.99,-33.59,;14.01,-35.12,;12.65,-32.84,;11.32,-33.63,;9.99,-32.88,;9.97,-31.35,;11.27,-30.55,;12.62,-31.3,;8.62,-30.6,;7.3,-31.4,;5.96,-30.65,;5.92,-29.1,;4.57,-28.36,;3.27,-29.17,;3.32,-30.7,;1.9,-28.44,;.69,-29.39,;-.59,-28.53,;-.17,-27.05,;1.38,-26.98,;2.14,-25.65,;3.68,-25.64,;1.37,-24.32,;2.76,-24.25,;-1.94,-29.27,;-3.26,-28.47,;-4.61,-29.21,;-4.65,-30.75,;-3.32,-31.55,;-1.97,-30.81,;7.25,-28.31,;8.6,-29.06,)\|
BDBM50341782	OC(=O)[C@H]1CC[C@@H](CC1)C(=O)N1CCC(CC1)c1ccc(NC(=O)c2nc(oc2C(F)(F)F)-c2ccccc2)cc1 \|r,wU:6.9,wD:3.2,(20.61,-31.2,;19.27,-30.45,;19.25,-28.91,;17.95,-31.23,;16.6,-30.48,;15.28,-31.27,;15.31,-32.8,;16.65,-33.55,;17.96,-32.77,;13.99,-33.59,;14.01,-35.12,;12.65,-32.84,;11.32,-33.63,;9.99,-32.88,;9.97,-31.35,;11.27,-30.55,;12.62,-31.3,;8.62,-30.6,;7.3,-31.4,;5.96,-30.65,;5.92,-29.1,;4.57,-28.36,;3.27,-29.17,;3.32,-30.7,;1.9,-28.44,;.69,-29.39,;-.59,-28.53,;-.17,-27.05,;1.38,-26.98,;2.14,-25.65,;3.68,-25.64,;1.37,-24.32,;2.76,-24.25,;-1.94,-29.27,;-3.26,-28.47,;-4.61,-29.21,;-4.65,-30.75,;-3.32,-31.55,;-1.97,-30.81,;7.25,-28.31,;8.6,-29.06,)\|
BDBM50341783	OC(=O)[C@H]1CC[C@H](CC1)C(=O)N1CCC(CC1)c1ccc(NC(=O)c2nc(oc2C(F)(F)F)-c2ccccc2)cc1 \|r,wU:6.9,3.2,(20.61,-31.2,;19.27,-30.45,;19.25,-28.91,;17.95,-31.23,;17.96,-32.77,;16.65,-33.55,;15.31,-32.8,;15.28,-31.27,;16.6,-30.48,;13.99,-33.59,;14.01,-35.12,;12.65,-32.84,;11.32,-33.63,;9.99,-32.88,;9.97,-31.35,;11.27,-30.55,;12.62,-31.3,;8.62,-30.6,;7.3,-31.4,;5.96,-30.65,;5.92,-29.1,;4.57,-28.36,;3.27,-29.17,;3.32,-30.7,;1.9,-28.44,;.69,-29.39,;-.59,-28.53,;-.17,-27.05,;1.38,-26.98,;2.14,-25.65,;3.68,-25.64,;1.37,-24.32,;2.76,-24.25,;-1.94,-29.27,;-3.26,-28.47,;-4.61,-29.21,;-4.65,-30.75,;-3.32,-31.55,;-1.97,-30.81,;7.25,-28.31,;8.6,-29.06,)\|
BDBM50341784	FC(F)(F)COc1ccc(cn1)C(=O)NCCNC(=O)c1[nH]c(nc1C(F)(F)F)-c1ccccc1
BDBM50341785	OC(=O)[C@@H]1CCC[C@H]1C(=O)c1ccc(cc1)-c1ccc(NC(=O)Nc2ccccc2)c(F)c1 \|r\|
BDBM50354629	OC(=O)CNC(=O)c1ccc(cc1)-c1ccc(NC(=O)Nc2ccccc2)nc1
BDBM50354630	C[C@H](NC(=O)c1ccc(cc1)-c1ccc(NC(=O)Nc2ccccc2)nc1)C(O)=O \|r\|
BDBM50354631	OC[C@H](NC(=O)c1ccc(cc1)-c1ccc(NC(=O)Nc2ccccc2)nc1)C(O)=O \|r\|
BDBM50354632	CC(C)[C@H](NC(=O)c1ccc(cc1)-c1ccc(NC(=O)Nc2ccccc2)nc1)C(O)=O \|r\|
BDBM50354633	CC(C)[C@@H](NC(=O)c1ccc(cc1)-c1ccc(NC(=O)Nc2ccccc2)nc1)C(O)=O \|r\|
BDBM50354634	CC(C)C[C@H](NC(=O)c1ccc(cc1)-c1ccc(NC(=O)Nc2ccccc2)nc1)C(O)=O \|r\|
BDBM50354635	CC(C)[C@H](NC(=O)c1ccc(cc1)-c1ccc(NC(=O)Nc2ccc(F)cc2)nc1)C(O)=O \|r\|
BDBM50354636	CC(C)[C@H](NC(=O)c1ccc(cc1)-c1ccc(NC(=O)Nc2ccc(F)cc2F)nc1)C(O)=O \|r\|
BDBM50354637	CC(C)[C@H](NC(=O)c1ccc(cc1)-c1ccc(NC(=O)Nc2ccccc2F)cn1)C(O)=O \|r\|
BDBM50354638	CC(C)[C@H](NC(=O)c1ccc(cc1)-c1ccc(NC(=O)Nc2cccc(F)c2)cn1)C(O)=O \|r\|
BDBM50354639	CC(C)[C@H](NC(=O)c1ccc(cc1)-c1ccc(NC(=O)Nc2ccc(F)cc2)cn1)C(O)=O \|r\|
BDBM50354640	CC(C)[C@H](NC(=O)c1ccc(cc1)-c1ccc(NC(=O)Nc2ccccc2OC(F)(F)F)cn1)C(O)=O \|r\|
BDBM50354641	COc1ccc(NC(=O)Nc2ccc(nc2)-c2ccc(cc2)C(=O)N[C@@H](C(C)C)C(O)=O)cc1 \|r\|
BDBM50354642	CC(C)[C@H](NC(=O)c1ccc(cc1)-c1ccc(NC(=O)Nc2ccc(F)cc2F)cn1)C(O)=O \|r\|
BDBM50354643	OC(=O)[C@@H]1CCC[C@H]1C(=O)c1ccc(cc1)-c1ccc(Nc2nc3ccc(F)cc3s2)c(F)c1 \|r\|
BDBM50355142	Nc1ncnc2OCCN(c3ccc(cc3)[C@H]3CC[C@H](CC(O)=O)CC3)C(=O)c12 \|r,wU:16.16,wD:19.20,(-8.41,-1.48,;-8.4,-3.02,;-9.73,-3.79,;-9.73,-5.34,;-8.4,-6.11,;-7.06,-5.34,;-5.73,-6.38,;-4.15,-6.01,;-3.48,-4.52,;-4.27,-3.04,;-3.51,-1.7,;-1.98,-1.68,;-1.22,-.34,;-2.01,.98,;-3.56,.96,;-4.3,-.39,;-1.26,2.32,;-2.05,3.64,;-1.29,4.98,;.25,5,;1.01,6.34,;2.55,6.36,;3.33,5.03,;3.3,7.7,;1.03,3.67,;.28,2.34,;-5.83,-2.78,;-6.22,-1.29,;-7.07,-3.79,)\|
BDBM50355143	CC1(C)Oc2ncnc(N)c2NC1c1ccc(cc1)[C@H]1CC[C@H](CC(O)=O)CC1 \|r,wU:19.21,wD:22.25,(32.7,-2.92,;31.16,-2.92,;31.93,-4.25,;29.82,-3.7,;28.47,-2.93,;27.14,-3.7,;25.8,-2.93,;25.8,-1.38,;27.13,-.61,;27.13,.93,;28.47,-1.38,;29.8,-.59,;31.15,-1.37,;32.48,-.6,;33.82,-1.36,;35.14,-.58,;35.13,.97,;33.78,1.72,;32.46,.93,;36.45,1.75,;36.42,3.28,;37.76,4.07,;39.1,3.31,;40.43,4.09,;41.77,3.33,;41.78,1.79,;43.09,4.12,;39.11,1.77,;37.79,.99,)\|
BDBM50355144	Nc1ncnc2OC[C@@H](Oc12)c1ccc(cc1)[C@H]1CC[C@H](CC(O)=O)CC1 \|r,wU:17.19,8.12,wD:20.23,(-9.01,-11.21,;-9,-12.75,;-10.33,-13.52,;-10.33,-15.06,;-9,-15.83,;-7.66,-15.07,;-6.32,-15.83,;-4.98,-15.05,;-4.98,-13.5,;-6.33,-12.72,;-7.67,-13.51,;-3.65,-12.74,;-2.32,-13.49,;-.99,-12.71,;-1.01,-11.17,;-2.36,-10.41,;-3.68,-11.2,;.31,-10.39,;.29,-8.85,;1.62,-8.07,;2.96,-8.82,;4.29,-8.04,;5.63,-8.8,;5.64,-10.34,;6.96,-8.02,;2.98,-10.36,;1.66,-11.14,)\|
BDBM50355145	Nc1ncnc2OC[C@H](Oc12)c1ccc(cc1)[C@H]1CC[C@H](CC(O)=O)CC1 \|r,wU:17.19,wD:20.23,8.12,(9.41,-10.55,;9.42,-12.09,;8.09,-12.86,;8.08,-14.41,;9.42,-15.18,;10.76,-14.41,;12.1,-15.18,;13.44,-14.4,;13.44,-12.85,;12.09,-12.07,;10.75,-12.86,;14.76,-12.08,;16.1,-12.84,;17.43,-12.06,;17.41,-10.51,;16.06,-9.76,;14.74,-10.55,;18.73,-9.73,;18.71,-8.2,;20.04,-7.41,;21.38,-8.17,;22.71,-7.39,;24.05,-8.15,;24.06,-9.69,;25.38,-7.36,;21.39,-9.71,;20.07,-10.49,)\|
BDBM50355146	NC(=O)C[C@H]1CC[C@@H](CC1)c1ccc(cc1)[C@H]1COc2ncnc(N)c2O1 \|r,wU:7.10,16.17,wD:4.3,(42.86,-8.87,;42.9,-7.33,;44.23,-6.55,;41.56,-6.57,;40.23,-7.35,;38.89,-6.6,;37.56,-7.38,;37.58,-8.92,;38.93,-9.67,;40.25,-8.89,;36.26,-9.7,;36.28,-11.24,;34.96,-12.02,;33.62,-11.27,;33.59,-9.73,;34.91,-8.94,;32.29,-12.03,;32.29,-13.58,;30.95,-14.36,;29.61,-13.6,;28.27,-14.36,;26.94,-13.59,;26.94,-12.05,;28.27,-11.28,;28.26,-9.74,;29.6,-12.04,;30.94,-11.25,)\|
BDBM50355147	Nc1ncnc2OC[C@@H](Oc12)c1ccc(cc1)[C@H]1CC[C@H](CC#N)CC1 \|r,wU:8.12,17.19,wD:20.23,(-8.65,-22.04,;-8.64,-23.58,;-9.97,-24.35,;-9.98,-25.9,;-8.64,-26.67,;-7.3,-25.9,;-5.96,-26.67,;-4.62,-25.88,;-4.62,-24.34,;-5.97,-23.56,;-7.31,-24.35,;-3.3,-23.57,;-1.96,-24.33,;-.63,-23.54,;-.65,-22,;-2,-21.25,;-3.32,-22.04,;.67,-21.22,;.65,-19.68,;1.98,-18.9,;3.32,-19.66,;4.65,-18.88,;4.63,-17.34,;4.61,-15.8,;3.33,-21.2,;2.01,-21.98,)\|
BDBM50355148	Cc1noc(C[C@H]2CC[C@@H](CC2)c2ccc(cc2)[C@H]2COc3ncnc(N)c3O2)n1 \|r,wU:18.19,9.12,wD:6.5,(23.76,-21.99,;22.81,-20.78,;23.24,-19.3,;21.96,-18.43,;20.75,-19.39,;19.41,-18.63,;18.08,-19.42,;16.74,-18.66,;15.41,-19.44,;15.43,-20.98,;16.78,-21.74,;18.1,-20.96,;14.11,-21.76,;14.13,-23.3,;12.8,-24.09,;11.47,-23.33,;11.44,-21.79,;12.76,-21.01,;10.14,-24.09,;10.14,-25.64,;8.8,-26.43,;7.46,-25.66,;6.12,-26.43,;4.79,-25.66,;4.79,-24.11,;6.12,-23.34,;6.11,-21.8,;7.45,-24.1,;8.79,-23.32,;21.28,-20.83,)\|
BDBM50355149	CC1(COc2ncnc(N)c2O1)c1ccc(cc1)[C@H]1CC[C@H](CC(O)=O)CC1 \|r,wU:18.20,wD:21.24,(33.4,-24.14,;32.31,-23.06,;32.32,-24.61,;30.97,-25.39,;29.63,-24.62,;28.3,-25.39,;26.96,-24.62,;26.96,-23.08,;28.29,-22.31,;28.29,-20.77,;29.63,-23.07,;30.96,-22.28,;33.64,-22.29,;34.98,-23.05,;36.3,-22.27,;36.29,-20.73,;34.93,-19.97,;33.62,-20.76,;37.61,-19.95,;37.58,-18.41,;38.91,-17.62,;40.26,-18.38,;41.58,-17.6,;42.93,-18.36,;42.94,-19.9,;44.25,-17.58,;40.27,-19.92,;38.95,-20.7,)\|
BDBM50358323	CCCn1[nH]c(=O)c2cc(NC(=O)c3nc(oc3C(F)(F)F)-c3ccccc3)ccc12
BDBM50358324	CC(C)c1ccc(NC(=O)c2nc(oc2C(F)(F)F)-c2ccccc2)cc1
BDBM50358325	CC(C)Oc1ccc(NC(=O)c2nc(oc2C(F)(F)F)-c2ccccc2)cc1
BDBM50358326	CCCc1ccc(NC(=O)c2nc(oc2C(F)(F)F)-c2ccccc2)cc1
BDBM50358327	FC(F)(F)c1oc(nc1C(=O)Nc1ccc(cc1)N1CCOCC1)-c1ccccc1
BDBM50358328	FC(F)(F)c1oc(nc1C(=O)Nc1ccc(nc1)N1CCOCC1)-c1ccccc1
BDBM50358329	FC(F)(F)c1oc(nc1C(=O)Nc1cnc(nc1)N1CCOCC1)-c1ccccc1
BDBM50358330	FC(F)(F)c1oc(nc1C(=O)Nc1cnc(s1)N1CCOCC1)-c1ccccc1
BDBM50358331	Clc1oc(nc1C(=O)Nc1ccc(nc1)N1CCOCC1)-c1ccccc1
BDBM50358332	CCc1oc(nc1C(=O)Nc1ccc(nc1)N1CCOCC1)-c1ccccc1
BDBM50358333	FC(F)(F)c1oc(cc1C(=O)Nc1ccc(nc1)N1CCOCC1)-c1ccccc1
BDBM50358334	Cc1nc(sc1C(=O)Nc1ccc(nc1)N1CCOCC1)-c1ccccc1
BDBM50358335	Cc1nc(oc1C(=O)Nc1ccc(nc1)N1CCOCC1)-c1ccccc1
BDBM50358336	Cc1nc(ncc1C(=O)Nc1ccc(cc1)N1CCOCC1)-c1ccccc1
BDBM50358337	CCN(CC)c1ccc(NC(=O)c2nc(oc2C(F)(F)F)-c2ccccc2)cn1
BDBM50358338	COCCNc1ccc(NC(=O)c2nc(oc2C(F)(F)F)-c2ccccc2)cn1
BDBM50358339	CN(CCO)c1ccc(NC(=O)c2nc(oc2C(F)(F)F)-c2ccccc2)cn1
BDBM50358340	CCN(CCOC)c1ccc(NC(=O)c2nc(oc2C(F)(F)F)-c2ccccc2)cn1
BDBM50358341	COCC(=O)N(C)c1ccc(NC(=O)c2nc(oc2C(F)(F)F)-c2ccccc2)cn1
BDBM50363956	Nc1ncnc2CCN(C(=O)c12)c1ccc(cc1)[C@H]1CC[C@H](CC(O)=O)CC1 \|r,wU:18.20,wD:21.24,(26.2,1.37,;26.2,-.17,;24.87,-.94,;24.87,-2.48,;26.21,-3.25,;27.53,-2.49,;28.87,-3.26,;30.21,-2.49,;30.22,-.94,;28.87,-.15,;28.87,1.38,;27.54,-.93,;31.55,-.18,;32.88,-.95,;34.21,-.19,;34.22,1.35,;32.88,2.13,;31.55,1.36,;35.56,2.12,;35.56,3.65,;36.9,4.42,;38.23,3.64,;39.57,4.4,;40.89,3.63,;40.89,2.09,;42.23,4.39,;38.22,2.1,;36.89,1.34,)\|
BDBM50362665	CC(C)(COc1ccc(cc1)-c1ccc(NC(=O)c2ccc3ccccc3c2)cc1)C(O)=O
BDBM50362666	Cc1cc(NC(=O)c2ccc3ccccc3c2)ccc1-c1ccc(OCC(C)(C)C(O)=O)nc1
BDBM50362667	CC(C)(COc1ccc(cn1)-c1ccc(NC(=O)c2ccc3ccccc3c2)cc1)C(O)=O
BDBM50362668	Cc1cc(NC(=O)c2ccc3ccccc3c2)ccc1-c1ccc(OCC(C)(C)C(O)=O)nn1
BDBM50362669	Cc1cc(NC(=O)c2ccc3ccccc3c2)ccc1-c1cnc(OCC(C)(C)C(O)=O)nc1
BDBM50362670	Cc1cc(NC(=O)c2ccc3ccccc3c2)ccc1-c1cnc(OCC(C)(C)C(O)=O)cn1
BDBM50362671	Cn1c(OCC(C)(C)C(=O)Nc2ccccc2)nnc1-c1ccc(NC(=O)c2ccc3ccccc3c2)cc1
BDBM50362672	CC(C)NC(=O)C(C)(C)COc1nnc(-c2ccc(NC(=O)c3ccc4ccccc4c3)cc2)n1C
BDBM50362673	CN(C)CCNC(=O)C(C)(C)COc1nnc(-c2ccc(NC(=O)c3ccc4ccccc4c3)cc2)n1C
BDBM50362674	Cn1c(CCC(O)=O)nnc1-c1ccc(NC(=O)c2ccc3ccccc3c2)cc1
BDBM50362675	Cn1c(OCC(C)(C)C(N)=O)nnc1-c1ccc(NC(=O)c2ccc3ccccc3c2)cc1
BDBM50362676	CN(C)C(=O)C(C)(C)COc1nnc(-c2ccc(NC(=O)c3ccc4ccccc4c3)cc2)n1C
BDBM50362677	Cn1c(OCC(C)(C)C(O)=O)nnc1-c1ccc(NC(=O)c2ccc3ccccc3c2)cc1
BDBM50362678	CCC(Sc1nnc(-c2ccc(NC(=O)c3ccc(Cl)c(Cl)c3)cc2)n1C)C(O)=O
BDBM50362679	CC(Oc1nnc(-c2ccc(NC(=O)c3ccc4ccccc4c3)cc2)n1C)C(O)=O
BDBM50362680	CC(Sc1nnc(-c2ccc(NC(=O)Cc3ccc(Cl)c(Cl)c3)cc2)n1C)C(O)=O
BDBM50362681	CC(Sc1nnc(-c2ccc(NC(=O)c3ccccc3C)cc2)n1C)C(O)=O
BDBM50362682	CC(Sc1nnc(-c2ccc(NC(=O)c3ccccc3)cc2)n1C)C(O)=O
BDBM50362683	CC(Sc1nnc(-c2ccc(NC(=O)c3cc4ccccc4s3)cc2)n1C)C(O)=O
BDBM50362684	CC(Sc1nnc(-c2ccc(NC(=O)c3ccc(Cl)c(Cl)c3)cc2)n1C)C(O)=O
BDBM50362685	CC(Sc1nnc(-c2ccc(NC(=O)c3ccc4ccccc4c3)cc2)n1C)C(O)=O
BDBM50362686	Cn1c(SC(C(O)=O)c2ccccc2)nnc1-c1ccc(NC(=O)c2ccc(Cl)c(Cl)c2)cc1
BDBM50362687	CC(Sc1nnc(-c2ccc(NC(=O)c3ccc(C)cc3)cc2)n1C)C(O)=O
BDBM50362688	Cc1cc(NC(=O)c2ccc3ccccc3c2)ccc1-c1ccc(OCC(C)(C)C(O)=O)cc1
BDBM50362689	Cc1cc(NC(=O)c2ccc3ccccc3c2)ccc1-c1ccc(OCC(C)(C)C(O)=O)cn1
BDBM50380025	OC(=O)C[C@H]1CC[C@@H](CC1)c1ccc(cc1)C(=O)Nc1nnc(COc2ccccc2)s1 \|r,wU:7.10,wD:4.3,(42.73,-17.37,;41.19,-17.39,;40.44,-18.73,;40.41,-16.07,;38.87,-16.09,;38.08,-14.76,;36.54,-14.78,;35.79,-16.13,;36.57,-17.45,;38.11,-17.43,;34.25,-16.15,;33.47,-14.83,;31.93,-14.85,;31.18,-16.18,;31.96,-17.5,;33.5,-17.49,;29.64,-16.2,;28.86,-14.87,;28.89,-17.54,;27.35,-17.56,;26.43,-16.32,;24.97,-16.82,;24.98,-18.36,;23.64,-19.11,;22.32,-18.33,;20.97,-19.08,;19.65,-18.29,;18.31,-19.05,;18.29,-20.59,;19.63,-21.37,;20.96,-20.62,;26.45,-18.82,)\|
BDBM50380026	OC(=O)C[C@H]1CC[C@H](CC1)c1ccc(cc1)C(=O)Nc1nnc(Cc2ccccc2)s1 \|r,wU:7.10,4.3,(41.76,-17.08,;40.22,-17.1,;39.47,-18.44,;39.43,-15.77,;37.89,-15.79,;37.13,-17.14,;35.59,-17.15,;34.81,-15.83,;35.56,-14.49,;37.1,-14.47,;33.28,-15.85,;32.49,-14.54,;30.95,-14.56,;30.21,-15.89,;30.98,-17.21,;32.52,-17.19,;28.67,-15.91,;27.88,-14.58,;27.91,-17.25,;26.36,-17.26,;25.45,-16.04,;23.99,-16.52,;24,-18.07,;22.66,-18.82,;21.33,-18.04,;21.35,-16.5,;20.03,-15.71,;18.68,-16.47,;18.67,-18.02,;20,-18.79,;25.48,-18.52,)\|
BDBM50380027	OC(=O)C[C@H]1CC[C@@H](CC1)c1ccc(cc1)C(=O)Nc1nnc(s1)-c1ccccc1 \|r,wU:7.10,wD:4.3,(15.1,-34.92,;13.56,-34.94,;12.8,-36.29,;12.77,-33.62,;11.23,-33.64,;10.44,-32.31,;8.9,-32.33,;8.15,-33.68,;8.93,-35,;10.47,-34.99,;6.62,-33.7,;5.83,-32.38,;4.3,-32.4,;3.55,-33.74,;4.33,-35.05,;5.87,-35.04,;2.01,-33.75,;1.25,-35.09,;1.22,-32.43,;-.32,-32.44,;-1.23,-31.21,;-2.69,-31.7,;-2.68,-33.24,;-1.21,-33.7,;-3.99,-34.05,;-5.34,-33.32,;-6.65,-34.12,;-6.61,-35.66,;-5.24,-36.39,;-3.94,-35.58,)\|
BDBM50380028	OC(=O)C[C@H]1CC[C@@H](CC1)c1ccc(cc1)C(=O)Nc1nnc(CCc2ccccc2)s1 \|r,wU:7.10,wD:4.3,(41.1,-9.44,;39.56,-9.46,;38.8,-10.8,;38.77,-8.13,;37.23,-8.15,;36.44,-6.83,;34.9,-6.85,;34.15,-8.19,;34.93,-9.51,;36.47,-9.5,;32.62,-8.21,;31.83,-6.89,;30.3,-6.92,;29.55,-8.25,;30.32,-9.57,;31.87,-9.55,;28.01,-8.26,;27.22,-6.94,;27.25,-9.61,;25.71,-9.62,;24.79,-8.39,;23.33,-8.88,;23.35,-10.42,;22.01,-11.18,;20.68,-10.39,;19.34,-11.15,;18.02,-10.36,;16.68,-11.11,;16.66,-12.66,;17.99,-13.44,;19.33,-12.68,;24.82,-10.88,)\|
BDBM50380029	OC(=O)C[C@H]1CC[C@@H](CC1)c1ccc(cc1)C(=O)Nc1nnc(Cc2ccc(F)cc2)s1 \|r,wU:7.10,wD:4.3,(44.87,1.11,;43.33,1.09,;42.57,-.25,;42.54,2.42,;41,2.4,;40.21,3.72,;38.67,3.7,;37.92,2.35,;38.71,1.03,;40.24,1.05,;36.39,2.34,;35.61,3.65,;34.07,3.63,;33.32,2.3,;34.1,.98,;35.64,1,;31.78,2.28,;31,3.61,;31.02,.94,;29.48,.92,;28.56,2.16,;27.1,1.67,;27.12,.13,;25.78,-.63,;24.45,.15,;24.47,1.7,;23.15,2.48,;21.81,1.72,;20.48,2.51,;21.8,.18,;23.12,-.6,;28.59,-.33,)\|
BDBM50380030	COc1ccc(Cc2nnc(NC(=O)c3ccc(cc3)[C@H]3CC[C@H](CC(O)=O)CC3)s2)cc1 \|r,wU:20.20,wD:23.24,(-7.01,3.75,;-7.02,2.21,;-5.7,1.43,;-4.35,2.18,;-3.03,1.4,;-3.05,-.14,;-1.73,-.93,;-.38,-.17,;-.4,1.37,;1.06,1.86,;1.98,.63,;3.52,.65,;4.28,1.99,;3.49,3.31,;5.82,2,;6.56,3.34,;8.1,3.36,;8.88,2.04,;8.14,.7,;6.59,.68,;10.42,2.06,;11.17,3.4,;12.71,3.43,;13.5,2.1,;15.04,2.12,;15.82,.8,;17.36,.82,;15.07,-.55,;12.74,.75,;11.2,.74,;1.09,-.63,;-4.38,-.9,;-5.71,-.12,)\|
BDBM50380031	COc1ccc(cc1)-c1nnc(NC(=O)c2ccc(cc2)[C@H]2CC[C@H](CC(O)=O)CC2)s1 \|r,wU:21.22,wD:24.26,(-9.2,-20.68,;-7.88,-21.46,;-6.54,-20.71,;-6.52,-19.17,;-5.18,-18.41,;-3.86,-19.2,;-3.87,-20.73,;-5.2,-21.49,;-2.51,-18.45,;-2.53,-16.9,;-1.07,-16.41,;-.15,-17.64,;1.39,-17.63,;2.14,-16.29,;1.36,-14.96,;3.68,-16.27,;4.43,-14.94,;5.97,-14.91,;6.75,-16.23,;6,-17.57,;4.46,-17.59,;8.29,-16.22,;9.04,-14.87,;10.58,-14.85,;11.37,-16.17,;12.91,-16.15,;13.69,-17.48,;15.23,-17.46,;12.94,-18.82,;10.61,-17.52,;9.07,-17.53,;-1.04,-18.9,)\|
BDBM50380032	OC(=O)C[C@H]1CC[C@@H](CC1)c1ccc(cc1)C(=O)Nc1nnc(s1)C12CC3CC(CC(C3)C1)C2 \|r,wU:7.10,wD:4.3,TLB:22:24:27:31.29.30,THB:29:28:25:31.30.32,29:30:27.28.33:25,32:30:27:33.24.25,32:24:27:31.29.30,(7.65,-23.26,;6.87,-24.59,;7.63,-25.93,;5.32,-24.58,;4.54,-25.91,;3,-25.9,;2.22,-27.23,;2.98,-28.57,;4.52,-28.58,;5.31,-27.26,;2.2,-29.9,;.67,-29.88,;-.11,-31.21,;.65,-32.55,;2.18,-32.56,;2.97,-31.23,;-.14,-33.88,;.63,-35.22,;-1.68,-33.86,;-2.46,-35.19,;-4,-35.11,;-4.56,-36.55,;-3.38,-37.53,;-2.07,-36.69,;-3.38,-39.06,;-4.73,-39.54,;-4.72,-41.03,;-5.92,-42.31,;-4.41,-41.88,;-3,-42.44,;-1.99,-41.17,;-3.39,-41.52,;-1.98,-39.64,;-4.43,-40.29,)\|
BDBM50380033	OC(=O)C[C@H]1CC[C@@H](CC1)c1ccc(cc1)C(=O)Nc1nnc(s1)N1CCOCC1 \|r,wU:7.10,wD:4.3,(36.11,-34.7,;34.57,-34.72,;33.81,-36.06,;33.77,-33.39,;32.23,-33.41,;31.45,-32.08,;29.91,-32.11,;29.15,-33.45,;29.94,-34.78,;31.48,-34.76,;27.62,-33.47,;26.84,-32.15,;25.3,-32.17,;24.55,-33.51,;25.33,-34.83,;26.87,-34.81,;23,-33.52,;22.25,-34.87,;22.22,-32.2,;20.68,-32.21,;19.76,-30.98,;18.3,-31.47,;18.31,-33.02,;19.79,-33.47,;17,-33.82,;15.65,-33.09,;14.34,-33.9,;14.39,-35.44,;15.75,-36.17,;17.05,-35.35,)\|
BDBM50380034	CC(C)(C)c1nnc(NC(=O)c2ccc(cc2)[C@H]2CC[C@H](CC(O)=O)CC2)s1 \|r,wU:17.17,wD:20.21,(-7.86,-10.55,;-6.53,-11.33,;-6.55,-12.87,;-7.87,-12.09,;-5.19,-10.58,;-5.21,-9.04,;-3.75,-8.55,;-2.83,-9.78,;-1.29,-9.76,;-.53,-8.42,;-1.32,-7.09,;1.01,-8.4,;1.76,-7.07,;3.29,-7.05,;4.08,-8.37,;3.33,-9.71,;1.79,-9.72,;5.61,-8.35,;6.36,-7,;7.9,-6.98,;8.69,-8.31,;10.23,-8.29,;11.02,-9.61,;12.56,-9.59,;10.26,-10.95,;7.93,-9.65,;6.39,-9.67,;-3.72,-11.04,)\|
BDBM50380035	OC(=O)C[C@H]1CC[C@@H](CC1)c1ccc(cc1)C(=O)Nc1nnc(s1)C1(CC1)c1cccc(F)c1 \|r,wU:7.10,wD:4.3,(44.94,-1.3,;43.39,-1.32,;42.64,-2.67,;42.61,.01,;41.06,-.01,;40.27,1.31,;38.73,1.29,;37.98,-.06,;38.76,-1.38,;40.3,-1.36,;36.44,-.07,;35.66,1.25,;34.12,1.22,;33.37,-.11,;34.15,-1.43,;35.69,-1.42,;31.83,-.13,;31.07,-1.47,;31.04,1.2,;29.5,1.18,;28.58,2.42,;27.11,1.93,;27.13,.38,;28.6,-.08,;25.78,-.37,;26.55,-1.7,;25.01,-1.69,;24.46,.41,;24.48,1.96,;23.15,2.74,;21.81,1.98,;21.8,.43,;20.45,-.33,;23.12,-.35,)\|
BDBM50380036	OC(=O)C[C@H]1CC[C@@H](CC1)c1ccc(cc1)C(=O)Nc1nnc(Br)s1 \|r,wU:7.10,wD:4.3,(36.31,.53,;34.77,.51,;34.02,-.83,;33.99,1.83,;32.45,1.81,;31.66,3.14,;30.12,3.12,;29.37,1.77,;30.15,.45,;31.69,.47,;27.83,1.75,;27.05,3.07,;25.51,3.05,;24.76,1.72,;25.54,.4,;27.08,.41,;23.22,1.7,;22.44,3.02,;22.47,.36,;20.93,.34,;20.01,1.57,;18.55,1.08,;18.56,-.46,;17.22,-1.21,;20.03,-.92,)\|
BDBM50380037	OC(=O)C[C@H]1CC[C@@H](CC1)c1ccc(cc1)C(=O)Nc1nnc(s1)-c1ccncc1 \|r,wU:7.10,wD:4.3,(42.4,-35.18,;40.86,-35.2,;40.11,-36.54,;40.07,-33.87,;38.53,-33.89,;37.74,-32.57,;36.2,-32.59,;35.45,-33.94,;36.23,-35.26,;37.77,-35.24,;33.92,-33.95,;33.13,-32.63,;31.59,-32.66,;30.84,-33.99,;31.62,-35.31,;33.17,-35.29,;29.3,-34.01,;28.55,-35.35,;28.52,-32.68,;26.98,-32.7,;26.06,-31.46,;24.6,-31.95,;24.61,-33.5,;26.08,-33.96,;23.3,-34.31,;21.95,-33.57,;20.63,-34.38,;20.68,-35.92,;22.05,-36.65,;23.35,-35.84,)\|
BDBM50380038	OC(=O)C[C@H]1CC[C@@H](CC1)c1ccc(cc1)C(=O)Nc1nnc(Cc2ccc(Cl)cc2)s1 \|r,wU:7.10,wD:4.3,(15.13,-16.75,;13.59,-16.77,;12.84,-18.12,;12.8,-15.45,;11.26,-15.47,;10.47,-14.14,;8.94,-14.17,;8.19,-15.51,;8.97,-16.83,;10.5,-16.82,;6.65,-15.53,;5.87,-14.21,;4.33,-14.23,;3.58,-15.57,;4.36,-16.89,;5.9,-16.87,;2.04,-15.58,;1.26,-14.26,;1.29,-16.92,;-.25,-16.94,;-1.17,-15.71,;-2.63,-16.2,;-2.62,-17.74,;-3.96,-18.5,;-5.28,-17.71,;-5.26,-16.17,;-6.59,-15.39,;-7.93,-16.14,;-9.26,-15.36,;-7.94,-17.69,;-6.62,-18.47,;-1.15,-18.2,)\|
BDBM50380039	CS(=O)(=O)c1nnc(NC(=O)c2ccc(cc2)[C@H]2CC[C@H](CC(O)=O)CC2)s1 \|r,wU:17.17,wD:20.21,(-7.95,-.77,;-6.62,-1.56,;-7.4,-2.88,;-5.86,-2.88,;-5.28,-.8,;-5.29,.74,;-3.83,1.23,;-2.91,-0,;-1.37,.02,;-.62,1.36,;-1.4,2.68,;.92,1.37,;1.67,2.71,;3.21,2.73,;3.99,1.41,;3.24,.07,;1.7,.05,;5.53,1.43,;6.28,2.78,;7.82,2.8,;8.61,1.47,;10.15,1.49,;10.94,.17,;12.48,.19,;10.18,-1.18,;7.85,.12,;6.31,.11,;-3.81,-1.26,)\|
BDBM50380040	OC(=O)CC1CCC(CC1)c1ccc(Nc2nnc(Cc3ccccc3)s2)cc1 \|(40.12,.86,;38.78,.12,;38.74,-1.42,;37.46,.91,;36.11,.17,;36.08,-1.37,;34.73,-2.11,;33.41,-1.32,;33.43,.22,;34.78,.97,;32.06,-2.06,;32.04,-3.6,;30.69,-4.34,;29.38,-3.55,;28.03,-4.3,;26.77,-3.41,;26.74,-1.87,;25.27,-1.42,;24.38,-2.68,;22.84,-2.72,;22.11,-4.08,;20.57,-4.12,;19.83,-5.47,;20.64,-6.79,;22.19,-6.73,;22.91,-5.39,;25.3,-3.92,;29.4,-2.02,;30.75,-1.27,)\|
BDBM50380041	CC(C)[C@H](NC(=O)c1ccc(cc1)-c1ccc(Nc2nnc(Cc3ccccc3)s2)cc1)C(O)=O \|r\|
BDBM50380042	CN(C(=O)c1ccc(cc1)[C@H]1CC[C@H](CC(O)=O)CC1)c1nnc(Cc2ccccc2)s1 \|r,wU:10.10,wD:13.14,(1.5,-10.77,;.72,-9.44,;1.48,-8.1,;.69,-6.78,;3.02,-8.09,;3.77,-6.75,;5.3,-6.73,;6.09,-8.04,;5.34,-9.39,;3.79,-9.4,;7.63,-8.03,;8.37,-6.68,;9.91,-6.66,;10.71,-7.98,;12.25,-7.96,;13.03,-9.29,;14.57,-9.27,;12.28,-10.63,;9.94,-9.33,;8.41,-9.35,;-.82,-9.46,;-1.74,-8.23,;-3.2,-8.72,;-3.18,-10.26,;-4.53,-11.01,;-5.85,-10.23,;-5.83,-8.69,;-7.16,-7.9,;-8.5,-8.66,;-8.52,-10.21,;-7.19,-10.98,;-1.71,-10.72,)\|
BDBM50380043	OC(=O)C[C@H]1CC[C@@H](CC1)c1ccc(cc1)C(=O)Nc1nnc(CCC2CCCC2)s1 \|r,wU:7.10,wD:4.3,(43.94,-23.77,;42.4,-23.79,;41.65,-25.13,;41.61,-22.47,;40.07,-22.48,;39.28,-21.16,;37.74,-21.18,;36.99,-22.53,;37.78,-23.85,;39.31,-23.83,;35.46,-22.54,;34.68,-21.23,;33.14,-21.25,;32.39,-22.58,;33.17,-23.9,;34.71,-23.89,;30.85,-22.6,;30.07,-21.27,;30.1,-23.94,;28.56,-23.96,;27.64,-22.72,;26.18,-23.21,;26.19,-24.76,;24.85,-25.51,;23.53,-24.73,;22.3,-25.65,;20.82,-25.21,;19.94,-26.47,;20.87,-27.7,;22.32,-27.2,;27.66,-25.22,)\|
BDBM50380044	OC(=O)C[C@H]1CC[C@@H](CC1)c1ccc(cc1)C(=O)Nc1nnc(CC2CCCC2)s1 \|r,wU:7.10,wD:4.3,(41.54,-33.26,;40,-33.28,;39.25,-34.62,;39.22,-31.95,;37.68,-31.97,;36.89,-30.65,;35.35,-30.67,;34.6,-32.02,;35.38,-33.34,;36.92,-33.32,;33.07,-32.03,;32.28,-30.72,;30.75,-30.74,;30,-32.07,;30.77,-33.39,;32.32,-33.37,;28.46,-32.09,;27.67,-30.76,;27.7,-33.43,;26.16,-33.45,;25.24,-32.21,;23.78,-32.7,;23.8,-34.24,;22.46,-35,;21.24,-34.06,;21.28,-32.52,;19.83,-32,;18.89,-33.22,;19.76,-34.49,;25.27,-34.7,)\|
BDBM50380045	OC(=O)C[C@H]1CC[C@@H](CC1)c1ccc(cc1)C(=O)Nc1nnc(Cc2ccccc2)s1 \|r,wU:4.3,wD:7.10,(15.69,-16.29,;14.15,-16.31,;13.4,-17.65,;13.37,-14.98,;11.83,-15,;11.06,-16.35,;9.53,-16.36,;8.75,-15.04,;9.49,-13.7,;11.03,-13.68,;7.21,-15.06,;6.42,-13.75,;4.89,-13.77,;4.14,-15.1,;4.91,-16.42,;6.46,-16.4,;2.6,-15.12,;1.81,-13.79,;1.84,-16.46,;.3,-16.47,;-.62,-15.25,;-2.08,-15.73,;-2.06,-17.28,;-3.41,-18.03,;-4.73,-17.25,;-4.71,-15.71,;-6.04,-14.92,;-7.38,-15.68,;-7.39,-17.23,;-6.07,-18,;-.59,-17.73,)\|
BDBM50380046	OC(=O)C[C@H]1CC[C@@H](CC1)c1ccc(cc1)C(=O)Nc1nnc(Cc2cccc(F)c2)s1 \|r,wU:7.10,wD:4.3,(15.26,-9.38,;13.72,-9.4,;12.97,-10.74,;12.94,-8.08,;11.4,-8.1,;10.61,-6.77,;9.07,-6.79,;8.32,-8.14,;9.1,-9.46,;10.64,-9.44,;6.78,-8.16,;6,-6.84,;4.46,-6.86,;3.72,-8.19,;4.49,-9.51,;6.04,-9.5,;2.18,-8.21,;1.39,-6.88,;1.42,-9.55,;-.12,-9.57,;-1.04,-8.33,;-2.5,-8.83,;-2.48,-10.37,;-3.83,-11.12,;-5.15,-10.34,;-6.48,-11.09,;-7.81,-10.32,;-7.8,-8.77,;-6.45,-8.01,;-6.44,-6.47,;-5.13,-8.8,;-1.01,-10.83,)\|
BDBM50380047	OC(=O)C[C@H]1CC[C@@H](CC1)c1ccc(cc1)C(=O)Nc1nnc(Cc2cccc(Cl)c2)s1 \|r,wU:7.10,wD:4.3,(44.73,-17.98,;43.19,-18,;42.43,-19.34,;42.4,-16.67,;40.86,-16.69,;40.07,-15.37,;38.53,-15.39,;37.78,-16.74,;38.57,-18.05,;40.1,-18.04,;36.25,-16.75,;35.47,-15.43,;33.93,-15.46,;33.18,-16.79,;33.96,-18.11,;35.5,-18.09,;31.64,-16.81,;30.86,-15.48,;30.88,-18.15,;29.34,-18.16,;28.42,-16.93,;26.96,-17.42,;26.98,-18.96,;25.64,-19.72,;24.31,-18.93,;24.33,-17.39,;23.01,-16.61,;21.67,-17.36,;21.66,-18.91,;20.32,-19.67,;22.98,-19.69,;28.45,-19.42,)\|
BDBM50380048	OC(=O)C[C@H]1CC[C@@H](CC1)c1ccc(cc1)C(=O)Nc1nnc(Cc2ccccc2F)s1 \|r,wU:7.10,wD:4.3,(42.15,-8.67,;40.61,-8.69,;39.86,-10.04,;39.82,-7.37,;38.28,-7.39,;37.49,-6.06,;35.96,-6.08,;35.21,-7.43,;35.99,-8.75,;37.52,-8.74,;33.67,-7.45,;32.89,-6.13,;31.35,-6.15,;30.6,-7.49,;31.38,-8.8,;32.92,-8.79,;29.06,-7.5,;28.28,-6.18,;28.31,-8.84,;26.77,-8.86,;25.85,-7.63,;24.39,-8.12,;24.4,-9.66,;23.06,-10.41,;21.74,-9.63,;21.76,-8.09,;20.43,-7.31,;19.09,-8.06,;19.08,-9.61,;20.4,-10.39,;20.39,-11.93,;25.87,-10.12,)\|
BDBM50380049	OC(=O)C[C@H]1CC[C@@H](CC1)c1ccc(cc1)C(=O)Nc1nnc(CCC2CCCCC2)s1 \|r,wU:7.10,wD:4.3,(15.04,-25.76,;13.5,-25.78,;12.74,-27.12,;12.71,-24.46,;11.17,-24.48,;10.38,-23.15,;8.84,-23.17,;8.09,-24.52,;8.87,-25.84,;10.41,-25.82,;6.56,-24.54,;5.77,-23.22,;4.24,-23.24,;3.49,-24.57,;4.27,-25.89,;5.81,-25.88,;1.95,-24.59,;1.17,-23.26,;1.19,-25.93,;-.35,-25.95,;-1.27,-24.71,;-2.72,-25.21,;-2.71,-26.75,;-4.05,-27.5,;-5.38,-26.72,;-6.72,-27.47,;-8.04,-26.68,;-9.38,-27.44,;-9.4,-28.98,;-8.06,-29.76,;-6.73,-29,;-1.24,-27.21,)\|
BDBM50380050	OC(=O)C[C@H]1CC[C@@H](CC1)c1ccc(cc1)C(=O)Nc1nnc(COc2ccc(F)cc2)s1 \|r,wU:7.10,wD:4.3,(44.91,-18.68,;43.37,-18.7,;42.62,-20.04,;42.59,-17.38,;41.05,-17.39,;40.26,-16.07,;38.72,-16.09,;37.97,-17.44,;38.75,-18.76,;40.29,-18.74,;36.44,-17.45,;35.65,-16.14,;34.11,-16.16,;33.36,-17.49,;34.14,-18.81,;35.69,-18.8,;31.82,-17.51,;31.04,-16.18,;31.07,-18.85,;29.53,-18.87,;28.61,-17.63,;27.15,-18.12,;27.16,-19.67,;25.82,-20.42,;24.5,-19.64,;23.15,-20.39,;21.83,-19.6,;20.49,-20.36,;20.47,-21.9,;19.13,-22.66,;21.81,-22.68,;23.14,-21.92,;28.63,-20.13,)\|
BDBM50380051	OC(=O)C[C@H]1CC[C@@H](CC1)c1ccc(cc1)C(=O)Nc1nnc(CCCc2ccc(F)cc2)s1 \|r,wU:7.10,wD:4.3,(22.05,-6.24,;20.51,-6.26,;19.76,-7.6,;19.72,-4.93,;18.18,-4.95,;17.39,-3.63,;15.85,-3.65,;15.1,-5,;15.89,-6.32,;17.42,-6.3,;13.57,-5.01,;12.79,-3.7,;11.25,-3.72,;10.5,-5.05,;11.28,-6.37,;12.82,-6.36,;8.96,-5.07,;8.18,-3.74,;8.2,-6.41,;6.66,-6.43,;5.75,-5.19,;4.29,-5.68,;4.3,-7.23,;3.03,-8.1,;1.64,-7.45,;.29,-8.19,;-1.02,-7.39,;-2.37,-8.13,;-3.69,-7.33,;-3.65,-5.79,;-4.97,-4.99,;-2.29,-5.05,;-.98,-5.85,;5.77,-7.69,)\|
BDBM50380052	OC(=O)C[C@H]1CC[C@@H](CC1)c1ccc(cc1)C(=O)Nc1nnc(CCC2CCC2)s1 \|r,wU:7.10,wD:4.3,(13.19,-35.05,;11.65,-35.07,;10.9,-36.41,;10.87,-33.74,;9.33,-33.76,;8.54,-32.44,;7,-32.46,;6.25,-33.81,;7.03,-35.13,;8.57,-35.11,;4.72,-33.82,;3.93,-32.51,;2.4,-32.53,;1.65,-33.86,;2.42,-35.18,;3.97,-35.16,;.11,-33.88,;-.68,-32.55,;-.65,-35.22,;-2.19,-35.23,;-3.11,-34,;-4.57,-34.49,;-4.55,-36.03,;-5.89,-36.79,;-7.22,-36,;-7.2,-34.46,;-6.1,-33.39,;-7.18,-32.29,;-8.28,-33.36,;-3.08,-36.49,)\|
BDBM50380053	OC(=O)C[C@H]1CC[C@@H](CC1)c1ccc(cc1)C(=O)Nc1nnc(CCc2ccc(F)cc2)s1 \|r,wU:7.10,wD:4.3,(18.16,-8.88,;16.62,-8.9,;15.86,-10.24,;15.83,-7.57,;14.29,-7.59,;13.5,-6.27,;11.96,-6.29,;11.21,-7.64,;12,-8.95,;13.53,-8.94,;9.68,-7.65,;8.89,-6.33,;7.36,-6.36,;6.61,-7.69,;7.39,-9.01,;8.93,-8.99,;5.07,-7.71,;4.29,-6.38,;4.31,-9.05,;2.77,-9.06,;1.85,-7.83,;.39,-8.32,;.41,-9.86,;-.93,-10.62,;-2.26,-9.83,;-3.6,-10.59,;-4.92,-9.8,;-6.26,-10.55,;-6.28,-12.1,;-7.62,-12.85,;-4.95,-12.88,;-3.61,-12.12,;1.88,-10.32,)\|
BDBM50380054	OC(=O)C[C@H]1CC[C@@H](CC1)c1ccc(cc1)C(=O)Nc1nnc(Cc2ccccc2Cl)s1 \|r,wU:7.10,wD:4.3,(15.75,-24.57,;14.21,-24.58,;13.46,-25.93,;13.43,-23.26,;11.89,-23.28,;11.1,-21.95,;9.56,-21.98,;8.81,-23.32,;9.59,-24.64,;11.13,-24.63,;7.28,-23.34,;6.49,-22.02,;4.95,-22.05,;4.21,-23.38,;4.98,-24.7,;6.53,-24.68,;2.67,-23.39,;1.88,-22.07,;1.91,-24.74,;.37,-24.75,;-.55,-23.52,;-2.01,-24.01,;-1.99,-25.55,;-3.34,-26.31,;-4.66,-25.52,;-4.64,-23.98,;-5.96,-23.2,;-7.31,-23.95,;-7.32,-25.5,;-5.99,-26.28,;-6,-27.82,;-.52,-26.01,)\|
BDBM50380055	OC(=O)C[C@H]1CC[C@@H](CC1)c1ccc(cc1)C(=O)Nc1nnc(s1)C1(CC1)c1ccccc1 \|r,wU:7.10,wD:4.3,(43.79,-25.35,;42.25,-25.37,;41.49,-26.72,;41.46,-24.05,;39.92,-24.06,;39.13,-22.74,;37.59,-22.76,;36.83,-24.11,;37.62,-25.43,;39.16,-25.41,;35.3,-24.12,;34.51,-22.81,;32.97,-22.83,;32.22,-24.16,;33,-25.48,;34.55,-25.47,;30.68,-24.18,;29.92,-25.52,;29.9,-22.85,;28.35,-22.87,;27.43,-21.63,;25.97,-22.12,;25.99,-23.67,;27.46,-24.13,;24.64,-24.42,;25.41,-25.75,;23.87,-25.74,;23.32,-23.64,;23.34,-22.1,;22.01,-21.31,;20.67,-22.07,;20.65,-23.62,;21.98,-24.4,)\|
BDBM50380056	OC(=O)C[C@H]1CC[C@@H](CC1)c1ccc(cc1)C(=O)Nc1nnc(SCc2ccccc2)s1 \|r,wU:7.10,wD:4.3,(15.65,-17.73,;14.11,-17.75,;13.35,-19.09,;13.32,-16.43,;11.78,-16.44,;10.99,-15.12,;9.45,-15.14,;8.7,-16.49,;9.48,-17.81,;11.02,-17.79,;7.17,-16.51,;6.38,-15.19,;4.85,-15.21,;4.1,-16.54,;4.87,-17.86,;6.42,-17.85,;2.56,-16.56,;1.77,-15.23,;1.8,-17.9,;.26,-17.92,;-.66,-16.68,;-2.12,-17.18,;-2.1,-18.72,;-3.45,-19.47,;-4.77,-18.69,;-6.11,-19.44,;-7.44,-18.65,;-8.78,-19.41,;-8.79,-20.95,;-7.46,-21.73,;-6.12,-20.98,;-.63,-19.18,)\|
BDBM50380057	OC(=O)CC[C@H]1CC[C@@H](CC1)c1ccc(cc1)C(=O)Nc1nnc(Cc2ccccc2)s1 \|r,wU:8.11,wD:5.4,(17.04,-2.19,;16.26,-.87,;17.02,.47,;14.72,-.88,;13.94,.45,;12.4,.43,;11.6,1.74,;10.06,1.72,;9.31,.38,;10.09,-.94,;11.63,-.92,;7.78,.37,;6.99,1.68,;5.45,1.65,;4.71,.32,;5.48,-.99,;7.03,-.98,;3.17,.3,;2.38,1.63,;2.41,-1.03,;.87,-1.05,;-.05,.18,;-1.51,-.31,;-1.5,-1.85,;-2.84,-2.6,;-4.17,-1.82,;-4.14,-.28,;-5.47,.51,;-6.82,-.25,;-6.83,-1.8,;-5.5,-2.58,;-.02,-2.31,)\|
BDBM50380058	OC(=O)C[C@H]1CC[C@@H](CC1)c1ccc(cc1)C(=O)Nc1nnc(s1)C1(CC1)c1ccc(F)cc1 \|r,wU:7.10,wD:4.3,(15.06,-2.32,;13.52,-2.33,;12.77,-3.68,;12.73,-1.01,;11.19,-1.03,;10.4,.3,;8.86,.28,;8.1,-1.07,;8.89,-2.39,;10.43,-2.38,;6.57,-1.09,;5.78,.23,;4.24,.21,;3.49,-1.13,;4.27,-2.45,;5.82,-2.43,;1.95,-1.14,;1.19,-2.49,;1.16,.19,;-.38,.17,;-1.3,1.41,;-2.76,.91,;-2.75,-.63,;-1.27,-1.09,;-4.09,-1.38,;-3.33,-2.71,;-4.86,-2.71,;-5.42,-.6,;-5.4,.94,;-6.72,1.73,;-8.07,.97,;-9.4,1.76,;-8.08,-.58,;-6.75,-1.36,)\|
BDBM50380059	OC(=O)C[C@H]1CC[C@@H](CC1)c1ccc(cc1)C(=O)Nc1nnc(s1)C1CCCC1 \|r,wU:7.10,wD:4.3,(12.28,-42.06,;10.74,-42.07,;9.98,-43.42,;9.95,-40.75,;8.41,-40.77,;7.62,-39.45,;6.08,-39.47,;5.33,-40.81,;6.11,-42.13,;7.65,-42.12,;3.8,-40.83,;3.01,-39.51,;1.48,-39.54,;.73,-40.87,;1.51,-42.19,;3.05,-42.17,;-.81,-40.88,;-1.6,-39.56,;-1.57,-42.23,;-3.11,-42.24,;-4.03,-41.01,;-5.49,-41.5,;-5.47,-43.04,;-4,-43.5,;-6.68,-44,;-8.17,-43.59,;-9.02,-44.87,;-8.06,-46.08,;-6.62,-45.54,)\|
BDBM50380060	CC(C)Cc1nnc(NC(=O)c2ccc(cc2)[C@H]2CC[C@H](CC(O)=O)CC2)s1 \|r,wU:17.17,wD:20.21,(19.4,-40.74,;19.33,-42.28,;17.96,-42.99,;20.62,-43.11,;21.99,-42.4,;21.98,-40.86,;23.44,-40.37,;24.36,-41.6,;25.9,-41.59,;26.65,-40.25,;25.87,-38.92,;28.19,-40.23,;28.94,-38.9,;30.48,-38.88,;31.26,-40.19,;30.51,-41.53,;28.97,-41.55,;32.79,-40.18,;33.54,-38.83,;35.08,-38.81,;35.87,-40.13,;37.41,-40.11,;38.2,-41.44,;39.74,-41.42,;37.45,-42.78,;35.11,-41.48,;33.58,-41.5,;23.46,-42.86,)\|
BDBM50388918	CCOC(=O)Nc1ccc2nc([nH]c2c1)-c1c(Cl)cccc1Cl
BDBM50388919	Cc1ccc(NC(=O)c2ccc3nc([nH]c3c2)-c2c(C)cccc2C)cc1C
BDBM50388920	COc1cc(C)c(-c2nc3ccc(cc3[nH]2)C(=O)Nc2ccc(C)c(C)c2)c(C)c1
BDBM50388921	Cc1ccc(NC(=O)c2ccc3nc([nH]c3c2)-c2c(C)cc(OCC(O)=O)cc2C)cc1C
BDBM50388922	Cc1ccc(NC(=O)c2ccc3nc([nH]c3c2)-c2c(C)cc(NCC(O)=O)cc2C)cc1C
BDBM50388923	Cc1ccc(NC(=O)c2ccc3nc([nH]c3c2)-c2c(C)cc(CCC(O)=O)cc2C)cc1C
BDBM50388924	Cc1cc(CCC(O)=O)cc(C)c1-c1nc2ccc(cc2[nH]1)C(=O)Nc1ccc(cc1)C(C)(C)C
BDBM50394726	Nc1c(cnc2ccnn12)-c1ccc(cc1)[C@H]1CC[C@H](CC(O)=O)CC1 \|r,wU:19.22,wD:16.18,(18.97,-45.21,;18.92,-46.74,;20.23,-47.56,;20.18,-49.09,;18.83,-49.82,;17.52,-49.01,;16.04,-49.44,;15.18,-48.17,;16.11,-46.95,;17.56,-47.47,;21.59,-46.83,;22.9,-47.64,;24.25,-46.91,;24.3,-45.37,;22.99,-44.56,;21.64,-45.29,;25.66,-44.64,;26.97,-45.45,;28.32,-44.72,;28.37,-43.19,;29.73,-42.46,;31.04,-43.26,;30.99,-44.81,;32.39,-42.54,;27.06,-42.37,;25.71,-43.1,)\|
BDBM50394729	Nc1c(cnc2ccnn12)-c1ccc(cc1)C1CCCCC1
BDBM50394727	CS(=O)(=O)c1ccc(cc1)-c1cnc2ccnn2c1N
BDBM50394728	Nc1c(cnc2ccnn12)-c1ccc(cc1)C(O)=O
BDBM50394730	CC(C)c1ccc(cc1)-c1cnc2ccnn2c1N
BDBM50394731	Nc1c(cnc2ccnn12)-c1ccccc1Br
BDBM50394732	Nc1c(cnc2ccnn12)-c1cccc(Br)c1
BDBM50394733	Nc1c(cnc2ccnn12)-c1ccc(Br)cc1
BDBM50394734	Nc1c(cnc2ccnn12)-c1ccccc1
BDBM50394735	CC(C)(C)c1ccc(cc1)-c1cnc2ccnn2c1N
BDBM50394736	CC(C)(C)c1ccc(cc1)-c1cncnc1N
BDBM50386149	CC(C)[C@H](NC(=O)c1ccc(cc1)-c1ccc(Nc2nc3ccc(F)cc3s2)cc1)C(O)=O \|r\|
BDBM50385398	OC(=O)C[C@H]1CC[C@@H](CC1)c1ccc(NC(=O)c2nnc(Nc3ccc(F)c(F)c3)o2)cc1 \|r,wU:4.3,wD:7.10,(19.62,-39.47,;18.85,-40.8,;17.31,-40.79,;19.62,-42.14,;21.16,-42.14,;21.93,-40.81,;23.47,-40.82,;24.23,-42.16,;23.46,-43.49,;21.93,-43.48,;25.77,-42.17,;26.55,-40.84,;28.08,-40.85,;28.84,-42.19,;30.38,-42.2,;31.16,-40.87,;30.4,-39.53,;32.71,-40.88,;33.18,-39.41,;34.72,-39.41,;35.19,-40.87,;36.52,-41.64,;37.85,-40.86,;37.84,-39.33,;39.16,-38.55,;40.51,-39.31,;41.84,-38.53,;40.52,-40.85,;41.85,-41.61,;39.19,-41.63,;33.95,-41.78,;28.07,-43.51,;26.54,-43.51,)\|
BDBM50385399	Cc1cc(NC(=O)c2nnc(Nc3ccccc3F)o2)ccc1N1CCOCC1
BDBM50385400	Fc1ccccc1Nc1nnc(o1)C(=O)Nc1ccc(nc1)N1CCOCC1
BDBM50385401	Fc1ccccc1Nc1nnc(o1)C(=O)Nc1ccc(cn1)N1CCOCC1
BDBM50385402	Fc1ccccc1Nc1nnc(o1)C(=O)Nc1ccc(cc1)N1CCCCC1
BDBM50385403	Fc1ccccc1Nc1nnc(o1)C(=O)Nc1ccc(nc1)N1CCSCC1
BDBM50385404	Fc1ccccc1Nc1nnc(o1)C(=O)Nc1ccc(nc1)N1CCS(=O)CC1
BDBM50385405	CN1CCN(CC1)c1ccc(NC(=O)c2nnc(Nc3ccccc3F)o2)cn1
BDBM50385406	CC(=O)N1CCN(CC1)c1ccc(NC(=O)c2nnc(Nc3ccccc3F)o2)cc1
BDBM50385407	CCCCc1ccc(NC(=O)c2nnc(Nc3ccccc3F)o2)cc1
BDBM50385408	Fc1ccccc1Nc1nnc(o1)C(=O)Nc1ccc(cc1)C1CCCCC1
BDBM50385409	Fc1ccccc1Nc1nnc(o1)C(=O)Nc1ccc(cc1)-c1ccccc1
BDBM50385410	COc1ccc(NC(=O)c2nnc(Nc3ccccc3F)o2)cn1
BDBM50385411	CCCCOc1ccc(NC(=O)c2nnc(Nc3ccccc3F)o2)cn1
BDBM50385412	Fc1ccccc1Nc1nnc(o1)C(=O)Nc1ccc(Oc2ccccc2)nc1
BDBM50385413	Fc1ccccc1Nc1nnc(o1)C(=O)Nc1ccc(Oc2cccnc2)nc1
BDBM50385414	Fc1ccccc1Nc1nnc(o1)C(=O)Nc1ccc(Nc2ccccc2)nc1
BDBM50385415	CCCCSc1ccc(NC(=O)c2nnc(Nc3ccccc3F)o2)cc1
BDBM50385416	O=C(Nc1ccc(nc1)N1CCOCC1)c1nnc(Nc2ccccc2)o1
BDBM50385417	Fc1cccc(Nc2nnc(o2)C(=O)Nc2ccc(nc2)N2CCOCC2)c1
BDBM50385418	Fc1ccc(Nc2nnc(o2)C(=O)Nc2ccc(nc2)N2CCOCC2)cc1F
BDBM50385419	Clc1ccccc1Nc1nnc(o1)C(=O)Nc1ccc(nc1)N1CCOCC1
BDBM50385420	Clc1cccc(Nc2nnc(o2)C(=O)Nc2ccc(nc2)N2CCOCC2)c1
BDBM50385421	Clc1ccc(Nc2nnc(o2)C(=O)Nc2ccc(nc2)N2CCOCC2)cc1
BDBM50385422	COc1cccc(Nc2nnc(o2)C(=O)Nc2ccc(nc2)N2CCOCC2)c1
BDBM50385423	CCOc1cccc(Nc2nnc(o2)C(=O)Nc2ccc(nc2)N2CCOCC2)c1
BDBM50385424	O=C(Nc1ccc(nc1)N1CCOCC1)c1nnc(Nc2cccc(Oc3ccccc3)c2)o1
BDBM50385425	O=C(Nc1ccc(nc1)N1CCOCC1)c1nnc(Nc2cccc(OCc3ccccc3)c2)o1
BDBM50385426	O=C(Nc1ccc(nc1)N1CCOCC1)c1nnc(Nc2cccc(OCc3ccccn3)c2)o1
BDBM50385427	O=C(Nc1ccc(nc1)N1CCOCC1)c1nnc(Nc2cccc(OCc3cccnc3)c2)o1
BDBM50385428	Cc1cccc(Nc2nnc(o2)C(=O)Nc2ccc(nc2)N2CCOCC2)c1
BDBM50385429	O=C(Nc1ccc(nc1)N1CCOCC1)c1nnc(Nc2cccc(c2)-c2ccccc2)o1
BDBM50385430	OC(=O)c1cccc(Nc2nnc(o2)C(=O)Nc2ccc(nc2)N2CCOCC2)c1
BDBM50385431	Clc1ccc(cc1)C(=O)Nc1nnc(o1)C(=O)Nc1ccc(cc1)N1CCOCC1
BDBM50385432	CC(C)(C(=O)Nc1nnc(o1)C(=O)Nc1ccc(cc1)N1CCOCC1)c1ccc(Cl)cc1
BDBM50385433	Clc1ccc(cc1)C1(CCC1)C(=O)Nc1nnc(o1)C(=O)Nc1ccc(cc1)N1CCOCC1
BDBM50385434	Clc1ccc(cc1)C1(CCCC1)C(=O)Nc1nnc(o1)C(=O)Nc1ccc(cc1)N1CCOCC1
BDBM50385435	OC(=O)CCCc1ccc(NC(=O)c2nnc(Nc3ccccc3F)o2)cc1
BDBM50385436	OC(=O)c1ccc(cc1)-c1ccc(NC(=O)c2nnc(Nc3ccccc3F)o2)cc1
BDBM50385437	OC(=O)Cc1ccc(cc1)-c1ccc(NC(=O)c2nnc(Nc3ccccc3F)o2)cc1
BDBM50385438	OC(=O)Cc1ccc(cc1)C1CCC(CC1)NC(=O)c1nnc(Nc2ccccc2F)o1 \|(19.57,-28.79,;18.8,-30.12,;17.25,-30.11,;19.56,-31.46,;21.1,-31.46,;21.88,-30.13,;23.42,-30.14,;24.18,-31.48,;23.41,-32.81,;21.87,-32.8,;25.71,-31.49,;26.49,-30.16,;28.03,-30.17,;28.79,-31.51,;28.02,-32.83,;26.48,-32.83,;30.33,-31.52,;31.11,-30.19,;30.34,-28.85,;32.65,-30.2,;33.12,-28.73,;34.66,-28.73,;35.14,-30.19,;36.46,-30.96,;37.79,-30.18,;37.78,-28.65,;39.11,-27.87,;40.45,-28.63,;40.46,-30.17,;39.13,-30.95,;39.14,-32.49,;33.9,-31.1,)\|
BDBM50385439	OC(=O)C[C@H]1CC[C@@H](CC1)c1ccc(NC(=O)c2nnc(Nc3ccccc3F)o2)cc1 \|r,wU:7.10,wD:4.3,(45.29,-27.64,;44.52,-28.98,;42.98,-28.97,;45.28,-30.31,;46.82,-30.32,;47.6,-31.66,;49.13,-31.66,;49.9,-30.34,;49.14,-29,;47.6,-28.99,;51.43,-30.34,;52.21,-29.01,;53.75,-29.02,;54.51,-30.36,;56.05,-30.37,;56.83,-29.04,;56.07,-27.71,;58.38,-29.05,;58.85,-27.59,;60.38,-27.59,;60.86,-29.05,;62.19,-29.81,;63.52,-29.04,;63.51,-27.5,;64.83,-26.72,;66.18,-27.49,;66.19,-29.03,;64.86,-29.81,;64.86,-31.35,;59.62,-29.96,;53.74,-31.69,;52.2,-31.69,)\|
BDBM50385440	OC(=O)C1CCC(CC1)c1ccc(NC(=O)c2nnc(Nc3ccccc3F)o2)cc1 \|(-8.73,-41.91,;-7.96,-43.25,;-8.74,-44.58,;-6.42,-43.26,;-5.64,-41.92,;-4.1,-41.93,;-3.34,-43.27,;-4.11,-44.6,;-5.65,-44.6,;-1.81,-43.28,;-1.03,-41.95,;.51,-41.96,;1.27,-43.3,;2.81,-43.31,;3.59,-41.98,;2.83,-40.64,;5.14,-41.99,;5.61,-40.53,;7.14,-40.52,;7.62,-41.98,;8.95,-42.75,;10.28,-41.97,;10.27,-40.44,;11.59,-39.66,;12.94,-40.42,;12.95,-41.96,;11.62,-42.74,;11.62,-44.28,;6.38,-42.89,;.5,-44.63,;-1.04,-44.62,)\|
BDBM50385441	Fc1ccccc1Nc1nnc(o1)C(=O)Nc1ccc(cc1)N1CCOCC1
BDBM50385442	Fc1ccccc1Nc1nnc(o1)C(=O)Nc1ccc(cc1F)N1CCOCC1
BDBM50385443	Fc1ccc(Nc2nnc(o2)C(=O)Nc2ccc(nc2)N2CCOCC2)cc1
BDBM50385444	OC(=O)Cc1cccc(c1)-c1ccc(NC(=O)c2nnc(Nc3ccccc3F)o2)cc1
BDBM50385445	O=C(Nc1ccc(cc1)N1CCOCC1)c1nnc(Nc2ccccc2)o1
BDBM50385446	O=C(Nc1ccc(cc1)N1CCOCC1)c1nnc(NC(=O)c2ccccc2)o1
BDBM50385447	Fc1ccccc1Nc1nnc(o1)C(=O)Nc1ccc(N2CCOCC2)c(F)c1
BDBM50009404	CN1CCN(C(=O)Nc2ccccc2)c2ccc(cc2C1)-c1ccc(cc1)[C@H]1CC[C@H](CC(O)=O)CC1 \|r,wU:27.30,wD:30.34,(7.13,-56.94,;6.55,-55.51,;5,-55.41,;4.1,-54.14,;4.54,-52.65,;3.32,-52.08,;3.31,-50.54,;1.99,-52.86,;.65,-52.1,;.64,-50.56,;-.7,-49.8,;-2.03,-50.58,;-2.02,-52.13,;-.68,-52.88,;5.98,-52.06,;5.95,-50.5,;7.28,-49.73,;8.62,-50.49,;8.64,-52.03,;7.33,-52.82,;7.58,-54.35,;9.95,-49.71,;11.29,-50.47,;12.61,-49.69,;12.6,-48.15,;11.25,-47.4,;9.93,-48.18,;13.93,-47.37,;13.91,-45.84,;15.24,-45.05,;16.58,-45.81,;17.91,-45.04,;19.25,-45.8,;19.26,-47.33,;20.57,-45.01,;16.59,-47.35,;15.27,-48.13,)\|
BDBM50009416	OC(=O)C[C@H]1CC[C@@H](CC1)c1ccc(cc1)-c1ccc2N(CCc2c1)C(=O)Nc1ccccc1 \|r,wU:7.10,wD:4.3,(33.08,-49.11,;33.07,-47.57,;34.4,-46.79,;31.73,-46.81,;30.4,-47.59,;29.06,-46.83,;27.73,-47.61,;27.75,-49.14,;29.09,-49.91,;30.41,-49.13,;26.42,-49.93,;26.44,-51.47,;25.11,-52.25,;23.77,-51.49,;23.75,-49.96,;25.07,-49.17,;22.44,-52.27,;21.1,-51.51,;19.77,-52.28,;19.8,-53.83,;18.48,-54.61,;19.1,-56.08,;20.84,-56.11,;21.15,-54.6,;22.46,-53.8,;17.14,-53.85,;17.13,-52.31,;15.81,-54.63,;14.47,-53.87,;14.46,-52.34,;13.12,-51.58,;11.79,-52.36,;11.81,-53.9,;13.15,-54.66,)\|
BDBM50009400	OC(=O)C[C@H]1CC[C@@H](CC1)c1ccc(cc1)-c1ccc2N(CCNc2c1)C(=O)Nc1ccccc1 \|r,wU:7.10,wD:4.3,(66.46,-34.73,;66.45,-33.2,;67.78,-32.41,;65.11,-32.43,;63.79,-33.21,;62.44,-32.45,;61.11,-33.24,;61.13,-34.77,;62.47,-35.53,;63.8,-34.75,;59.81,-35.55,;59.82,-37.09,;58.49,-37.87,;57.15,-37.11,;57.14,-35.58,;58.46,-34.8,;55.83,-37.89,;54.49,-37.13,;53.15,-37.9,;53.18,-39.46,;51.86,-40.24,;51.87,-41.78,;53.21,-42.54,;54.54,-41.76,;54.52,-40.22,;55.84,-39.43,;50.52,-39.48,;50.51,-37.94,;49.19,-40.26,;47.85,-39.5,;47.84,-37.96,;46.5,-37.2,;45.17,-37.98,;45.19,-39.53,;46.53,-40.28,)\|
BDBM50009432	OC(=O)C[C@H]1CC[C@@H](CC1)c1ccc(cc1)-c1ccc2N(CCOc2c1)C(=O)Nc1ccccc1 \|r,wU:7.10,wD:4.3,(49.67,-49.46,;49.66,-47.92,;50.99,-47.14,;48.32,-47.16,;46.99,-47.94,;45.65,-47.18,;44.32,-47.96,;44.34,-49.5,;45.68,-50.26,;47,-49.48,;43.01,-50.28,;43.03,-51.82,;41.7,-52.6,;40.36,-51.84,;40.34,-50.31,;41.66,-49.52,;39.03,-52.62,;37.69,-51.86,;36.36,-52.63,;36.39,-54.19,;35.07,-54.96,;35.08,-56.5,;36.42,-57.26,;37.75,-56.48,;37.73,-54.94,;39.05,-54.15,;33.73,-54.2,;33.72,-52.66,;32.4,-54.98,;31.06,-54.22,;31.05,-52.69,;29.71,-51.93,;28.38,-52.71,;28.4,-54.26,;29.74,-55.01,)\|
BDBM50009390	OC(=O)[C@@H]1CCC[C@H]1C(=O)c1ccc(cc1)-c1ccc(NC(=O)Nc2ccc(OC(F)(F)F)cc2)c(F)c1 \|r\|
BDBM50009392	OC(=O)C[C@H]1CC[C@@H](CC1)c1ccc(cc1)-c1ccc2oc(Nc3ccccc3)nc2c1 \|r,wU:7.10,wD:4.3,(21.48,-17.04,;21.51,-15.5,;22.85,-14.75,;20.19,-14.71,;18.84,-15.46,;17.52,-14.66,;16.17,-15.41,;16.15,-16.95,;17.48,-17.74,;18.82,-17,;14.81,-17.7,;14.78,-19.24,;13.44,-19.99,;12.12,-19.2,;12.14,-17.67,;13.48,-16.91,;10.77,-19.95,;10.75,-21.48,;9.42,-22.24,;8.09,-21.44,;6.61,-21.91,;5.71,-20.65,;4.17,-20.63,;3.42,-19.29,;4.2,-17.97,;3.45,-16.63,;1.91,-16.61,;1.12,-17.95,;1.88,-19.28,;6.63,-19.4,;8.1,-19.9,;9.45,-19.16,)\|
BDBM50009441	OC(=O)C[C@H]1CC[C@@H](CC1)c1ccc(cc1)-c1ccc2c(ccnc2c1)C(=O)Nc1ccccc1 \|r,wU:7.10,wD:4.3,(23.38,-4.8,;23.38,-3.27,;24.71,-2.49,;22.04,-2.5,;20.71,-3.28,;19.37,-2.51,;18.03,-3.29,;18.04,-4.82,;19.39,-5.59,;20.71,-4.82,;16.72,-5.6,;16.73,-7.15,;15.4,-7.92,;14.06,-7.15,;14.05,-5.62,;15.37,-4.84,;12.73,-7.93,;12.74,-9.48,;11.4,-10.25,;10.07,-9.49,;8.73,-10.26,;7.4,-9.49,;7.4,-7.95,;8.73,-7.18,;10.07,-7.94,;11.39,-7.17,;8.74,-11.8,;10.07,-12.57,;7.41,-12.58,;6.07,-11.81,;6.07,-10.27,;4.73,-9.5,;3.4,-10.28,;3.41,-11.83,;4.74,-12.59,)\|
BDBM50009443	CC(C)c1cccc(NC(=O)c2ccnc3cc(ccc23)-c2ccc(cc2)[C@H]2CC[C@H](CC(O)=O)CC2)c1 \|r,wU:27.29,wD:30.33,(29.37,-6.9,;28.04,-7.67,;26.71,-6.9,;28.04,-9.21,;26.71,-9.98,;26.72,-11.53,;28.05,-12.29,;29.38,-11.51,;30.72,-12.28,;32.05,-11.51,;33.38,-12.28,;32.04,-9.97,;30.71,-9.2,;30.71,-7.65,;32.04,-6.88,;33.38,-7.65,;34.7,-6.87,;36.04,-7.63,;36.05,-9.18,;34.71,-9.96,;33.38,-9.19,;37.37,-6.86,;38.71,-7.63,;40.04,-6.85,;40.03,-5.31,;38.68,-4.55,;37.36,-5.33,;41.35,-4.53,;41.34,-3,;42.68,-2.22,;44.02,-2.98,;45.35,-2.21,;46.69,-2.97,;46.69,-4.51,;48.02,-2.19,;44.02,-4.52,;42.7,-5.3,;29.38,-9.98,)\|
BDBM50009439	OC(=O)C[C@H]1CC[C@@H](CC1)c1ccc(cc1)-c1ccc2c(cccc2c1)C(=O)Nc1ccccc1 \|r,wU:7.10,wD:4.3,(69.09,-49.64,;69.08,-48.11,;70.4,-47.32,;67.74,-47.35,;66.41,-48.12,;65.07,-47.37,;63.74,-48.15,;63.75,-49.68,;65.1,-50.44,;66.42,-49.67,;62.43,-50.46,;62.44,-52,;61.12,-52.79,;59.77,-52.02,;59.76,-50.49,;61.08,-49.71,;58.45,-52.8,;57.11,-52.04,;55.78,-52.82,;55.8,-54.37,;54.48,-55.15,;54.49,-56.69,;55.83,-57.45,;57.17,-56.67,;57.15,-55.13,;58.47,-54.34,;53.14,-54.39,;53.13,-52.85,;51.82,-55.17,;50.48,-54.41,;50.46,-52.87,;49.12,-52.11,;47.8,-52.89,;47.81,-54.44,;49.15,-55.19,)\|
BDBM50009444	Cc1cc(C(=O)Nc2ccccc2)c2ccc(cc2n1)-c1ccc(cc1)[C@H]1CC[C@H](CC(O)=O)CC1 \|r,wU:26.29,wD:29.33,(49,-7.53,;50.33,-8.3,;50.33,-9.84,;51.67,-10.61,;51.67,-12.15,;53.01,-12.92,;50.34,-12.93,;49,-12.16,;49,-10.62,;47.67,-9.85,;46.33,-10.63,;46.34,-12.18,;47.68,-12.94,;53,-9.84,;54.34,-10.6,;55.67,-9.83,;55.66,-8.28,;54.32,-7.52,;53,-8.29,;51.66,-7.53,;56.99,-7.5,;58.33,-8.27,;59.66,-7.5,;59.65,-5.95,;58.3,-5.19,;56.98,-5.97,;60.98,-5.17,;60.97,-3.64,;62.3,-2.86,;63.64,-3.63,;64.97,-2.85,;66.31,-3.62,;66.31,-5.15,;67.64,-2.84,;63.65,-5.17,;62.32,-5.94,)\|
BDBM50009391	OC(=O)C[C@H]1CC[C@@H](CC1)c1ccc(cc1)-c1ccc2n(ccc2c1)C(=O)Nc1ccccc1 \|r,wU:7.10,wD:4.3,(65.24,-4.33,;65.41,-2.8,;66.81,-2.18,;64.16,-1.9,;62.75,-2.52,;61.51,-1.61,;60.09,-2.24,;59.94,-3.76,;61.19,-4.67,;62.59,-4.05,;58.53,-4.39,;58.37,-5.92,;56.96,-6.55,;55.72,-5.64,;55.88,-4.12,;57.28,-3.49,;54.31,-6.26,;53.07,-5.35,;51.66,-5.98,;51.5,-7.51,;50.25,-8.42,;50.73,-9.89,;52.28,-9.89,;52.75,-8.42,;54.15,-7.79,;48.79,-7.95,;48.46,-6.44,;47.64,-8.98,;46.18,-8.51,;45.86,-7,;44.4,-6.53,;43.25,-7.56,;43.58,-9.07,;45.04,-9.54,)\|
BDBM50009393	OC(=O)C[C@H]1CC[C@@H](CC1)c1ccc(cc1)-c1ccc2nc(Nc3ccccc3)ncc2c1 \|r,wU:7.10,wD:4.3,(43.43,-15.9,;43.42,-14.37,;44.75,-13.58,;42.08,-13.61,;40.75,-14.39,;39.41,-13.63,;38.08,-14.41,;38.1,-15.94,;39.44,-16.7,;40.76,-15.93,;36.77,-16.72,;36.78,-18.27,;35.46,-19.05,;34.12,-18.28,;34.1,-16.75,;35.42,-15.97,;32.79,-19.07,;32.81,-20.6,;31.49,-21.38,;30.15,-20.63,;28.82,-21.43,;27.47,-20.69,;26.15,-21.49,;24.8,-20.75,;24.77,-19.21,;23.42,-18.47,;22.11,-19.27,;22.15,-20.82,;23.5,-21.55,;27.43,-19.13,;28.76,-18.33,;30.12,-19.08,;31.45,-18.3,)\|
BDBM50009395	OC(=O)C[C@H]1CC[C@@H](CC1)c1ccc(cc1)-c1ccc2n(ncc2c1)C(=O)Nc1ccccc1 \|r,wU:7.10,wD:4.3,(22.24,-26.53,;22.26,-25,;23.61,-24.24,;20.94,-24.2,;19.6,-24.95,;18.27,-24.16,;16.92,-24.91,;16.91,-26.44,;18.23,-27.24,;19.57,-26.49,;15.56,-27.2,;15.54,-28.74,;14.2,-29.49,;12.87,-28.69,;12.89,-27.16,;14.23,-26.41,;11.53,-29.44,;10.21,-28.65,;8.86,-29.39,;8.84,-30.94,;7.67,-31.96,;8.28,-33.39,;9.82,-33.25,;10.17,-31.74,;11.51,-30.98,;6.17,-31.61,;5.72,-30.14,;5.12,-32.74,;3.62,-32.39,;3.18,-30.92,;1.68,-30.57,;.63,-31.7,;1.08,-33.18,;2.58,-33.52,)\|
BDBM50009396	OC(=O)C[C@H]1CC[C@@H](CC1)c1ccc(cc1)-c1ccc2cc([nH]c2c1)C(=O)Nc1ccccc1 \|r,wU:7.10,wD:4.3,(43.59,-26.51,;43.62,-24.98,;44.96,-24.23,;42.3,-24.19,;40.95,-24.93,;39.63,-24.14,;38.28,-24.89,;38.26,-26.43,;39.58,-27.22,;40.92,-26.47,;36.92,-27.18,;36.89,-28.72,;35.55,-29.47,;34.23,-28.68,;34.25,-27.15,;35.58,-26.39,;32.88,-29.43,;32.86,-30.96,;31.52,-31.71,;30.2,-30.92,;28.72,-31.39,;27.82,-30.12,;28.74,-28.88,;30.21,-29.37,;31.56,-28.63,;26.28,-30.11,;25.52,-28.77,;25.5,-31.43,;23.96,-31.42,;23.2,-30.08,;21.67,-30.06,;20.88,-31.39,;21.65,-32.73,;23.18,-32.74,)\|
BDBM50009397	OC(=O)C[C@H]1CC[C@@H](CC1)c1ccc(cc1)-c1ccc2c(c[nH]c2c1)C(=O)Nc1ccccc1 \|r,wU:7.10,wD:4.3,(67.26,-24.95,;67.29,-23.42,;68.63,-22.66,;65.97,-22.62,;64.62,-23.37,;63.3,-22.58,;61.95,-23.33,;61.93,-24.86,;63.25,-25.66,;64.59,-24.91,;60.59,-25.62,;60.56,-27.16,;59.22,-27.91,;57.9,-27.12,;57.92,-25.59,;59.25,-24.83,;56.55,-27.87,;55.23,-27.07,;53.88,-27.81,;53.87,-29.36,;52.69,-30.38,;53.3,-31.81,;54.85,-31.67,;55.2,-30.16,;56.53,-29.4,;51.19,-30.03,;50.74,-28.56,;50.14,-31.16,;48.64,-30.81,;48.2,-29.34,;46.7,-28.99,;45.65,-30.12,;46.11,-31.6,;47.6,-31.94,)\|
BDBM50009398	OC(=O)C[C@H]1CC[C@@H](CC1)c1ccc(cc1)-c1ccc2N(CCCc2c1)C(=O)Nc1ccccc1 \|r,wU:7.10,wD:4.3,(21.29,-37.92,;21.28,-36.38,;22.61,-35.6,;19.94,-35.62,;18.62,-36.4,;17.27,-35.64,;15.94,-36.42,;15.96,-37.95,;17.3,-38.72,;18.62,-37.94,;14.64,-38.74,;14.65,-40.28,;13.32,-41.06,;11.98,-40.3,;11.97,-38.77,;13.29,-37.98,;10.66,-41.08,;9.32,-40.32,;7.98,-41.09,;8.01,-42.64,;6.69,-43.42,;6.7,-44.96,;8.04,-45.72,;9.37,-44.94,;9.35,-43.4,;10.67,-42.61,;5.35,-42.66,;5.34,-41.12,;4.02,-43.44,;2.68,-42.68,;2.67,-41.15,;1.33,-40.39,;0,-41.17,;.02,-42.72,;1.36,-43.47,)\|
BDBM50009394	OC(=O)C[C@H]1CC[C@@H](CC1)c1ccc(cc1)-c1ccc2nc([nH]c2c1)C(=O)Nc1ccccc1 \|r,wU:7.10,wD:4.3,(68.06,-14.35,;68.09,-12.82,;69.43,-12.06,;66.77,-12.02,;65.42,-12.77,;64.1,-11.98,;62.75,-12.73,;62.73,-14.26,;64.05,-15.06,;65.39,-14.31,;61.39,-15.02,;61.36,-16.56,;60.02,-17.31,;58.7,-16.51,;58.72,-14.98,;60.05,-14.23,;57.35,-17.26,;57.33,-18.8,;55.99,-19.55,;54.66,-18.76,;53.19,-19.22,;52.29,-17.96,;53.21,-16.72,;54.68,-17.21,;56.03,-16.47,;50.75,-17.95,;49.99,-16.61,;49.97,-19.27,;48.43,-19.26,;47.67,-17.91,;46.13,-17.9,;45.35,-19.23,;46.11,-20.57,;47.65,-20.58,)\|
BDBM50009399	OC(=O)C[C@H]1CC[C@@H](CC1)c1ccc(cc1)-c1ccc2N(CCC(=O)c2c1)C(=O)Nc1ccccc1 \|r,wU:7.10,wD:4.3,(42.81,-36.7,;42.8,-35.16,;44.13,-34.38,;41.47,-34.4,;40.14,-35.18,;38.8,-34.42,;37.46,-35.2,;37.48,-36.74,;38.82,-37.5,;40.15,-36.72,;36.16,-37.52,;36.17,-39.06,;34.84,-39.84,;33.5,-39.08,;33.49,-37.55,;34.81,-36.77,;32.18,-39.86,;30.84,-39.1,;29.5,-39.87,;29.53,-41.43,;28.21,-42.21,;28.22,-43.75,;29.56,-44.51,;30.89,-43.72,;32.24,-44.48,;30.87,-42.19,;32.19,-41.4,;26.87,-41.45,;26.86,-39.91,;25.54,-42.23,;24.2,-41.47,;24.19,-39.93,;22.85,-39.17,;21.52,-39.95,;21.54,-41.5,;22.88,-42.25,)\|
BDBM50009445	Cc1cc(C(=O)NCCCCCc2ccccc2)c2ccc(cc2n1)-c1ccc(cc1)[C@H]1CC[C@H](CC(O)=O)CC1 \|r,wU:31.34,wD:34.38,(9.81,-20.41,;11.14,-21.18,;11.14,-22.72,;12.47,-23.49,;12.48,-25.03,;13.81,-25.8,;11.15,-25.81,;9.81,-25.04,;8.48,-25.81,;7.14,-25.05,;5.81,-25.82,;4.48,-25.05,;3.14,-25.83,;1.81,-25.05,;.48,-25.82,;.49,-27.37,;1.83,-28.13,;3.16,-27.36,;13.81,-22.72,;15.14,-23.48,;16.48,-22.71,;16.47,-21.16,;15.13,-20.4,;13.81,-21.17,;12.47,-20.41,;17.8,-20.38,;19.14,-21.15,;20.47,-20.38,;20.46,-18.83,;19.11,-18.07,;17.79,-18.85,;21.79,-18.05,;21.78,-16.52,;23.11,-15.74,;24.45,-16.51,;25.78,-15.73,;27.12,-16.5,;27.12,-18.03,;28.45,-15.72,;24.45,-18.05,;23.13,-18.82,)\|
BDBM50009446	Cc1cc(C(=O)Nc2ccccc2)c2ccc(cc2n1)-c1ccc(OCC(C)(C)C(O)=O)[n+]([O-])c1
BDBM50399677	Cc1nc(C)c(nc1C(N)=O)-c1ccc2c(CC[C@@]22CC[C@@H](CC2)c2nnn[nH]2)c1 \|r,wD:18.18,21.26,(4.06,-36.56,;5.39,-35.79,;6.73,-36.56,;8.06,-35.79,;9.4,-36.56,;8.06,-34.26,;6.73,-33.48,;5.39,-34.25,;4.06,-33.48,;2.73,-34.25,;4.06,-31.94,;9.39,-33.49,;9.39,-31.94,;10.72,-31.17,;12.06,-31.94,;12.07,-33.48,;13.54,-33.95,;14.44,-32.69,;13.52,-31.45,;12.42,-30.37,;12.82,-28.88,;14.3,-28.47,;15.39,-29.56,;15,-31.04,;14.7,-26.99,;13.72,-25.79,;14.55,-24.5,;16.04,-24.89,;16.13,-26.43,;10.72,-34.26,)\|
BDBM50399678	Cc1nc(C)c(nc1C(N)=O)-c1ccc2c(CC[C@@]22CC[C@H](Cc3nnn[nH]3)CC2)c1 \|r,wD:18.18,21.23,(61.99,-24.12,;63.32,-23.35,;64.66,-24.12,;65.99,-23.35,;67.32,-24.11,;65.99,-21.81,;64.65,-21.04,;63.32,-21.81,;61.99,-21.03,;60.65,-21.8,;61.99,-19.49,;67.32,-21.04,;67.32,-19.5,;68.65,-18.73,;69.98,-19.49,;69.99,-21.03,;71.46,-21.5,;72.36,-20.25,;71.45,-19,;70.35,-17.92,;70.75,-16.43,;72.23,-16.03,;72.63,-14.54,;74.11,-14.14,;74.67,-12.69,;76.2,-12.77,;76.61,-14.26,;75.32,-15.1,;73.32,-17.12,;72.93,-18.6,;68.65,-21.81,)\|
BDBM50399679	Cc1nc(C)c(nc1C(N)=O)-c1ccc2c(CC[C@@]22CC[C@@H](CC2)C(O)=O)c1 \|r,wD:18.18,21.26,(47.29,-23.74,;48.62,-22.97,;49.97,-23.74,;51.29,-22.97,;52.63,-23.74,;51.29,-21.44,;49.96,-20.66,;48.63,-21.43,;47.29,-20.66,;45.96,-21.43,;47.29,-19.12,;52.62,-20.67,;52.62,-19.12,;53.95,-18.35,;55.29,-19.12,;55.3,-20.66,;56.77,-21.13,;57.67,-19.87,;56.75,-18.63,;55.65,-17.55,;56.05,-16.06,;57.54,-15.65,;58.63,-16.74,;58.23,-18.22,;57.93,-14.17,;59.42,-13.76,;56.84,-13.08,;53.96,-21.44,)\|
BDBM50399680	Cc1nc(C)c(nc1C(N)=O)-c1ccc2c(CC[C@]22CC[C@@H](CC2)C(O)=O)c1 \|r,wU:21.26,wD:18.18,(32.89,-23.7,;34.23,-22.93,;35.57,-23.7,;36.9,-22.92,;38.23,-23.69,;36.9,-21.39,;35.56,-20.62,;34.23,-21.38,;32.9,-20.61,;31.56,-21.38,;32.9,-19.07,;38.23,-20.62,;38.23,-19.08,;39.56,-18.31,;40.89,-19.07,;40.9,-20.61,;42.37,-21.08,;43.27,-19.83,;42.35,-18.58,;43.84,-18.17,;44.23,-16.69,;43.14,-15.61,;41.65,-16.01,;41.26,-17.5,;43.53,-14.12,;45.02,-13.71,;42.44,-13.03,;39.56,-21.39,)\|
BDBM50399681	Cc1nc(C)c(nc1C(N)=O)-c1ccc2c(CC[C@@]22CC[C@H](CC(O)=O)CC2)c1 \|r,wD:18.18,21.23,(18.55,-22.65,;19.88,-21.88,;21.22,-22.65,;22.55,-21.88,;23.89,-22.64,;22.55,-20.34,;21.22,-19.57,;19.88,-20.34,;18.55,-19.56,;17.22,-20.33,;18.55,-18.02,;23.88,-19.57,;23.88,-18.03,;25.21,-17.26,;26.55,-18.02,;26.56,-19.56,;28.03,-20.03,;28.93,-18.78,;28.01,-17.53,;26.91,-16.45,;27.31,-14.96,;28.79,-14.56,;29.19,-13.07,;30.68,-12.67,;31.77,-13.75,;31.07,-11.18,;29.88,-15.65,;29.49,-17.13,;25.21,-20.34,)\|
BDBM50399682	Cc1nc(C)c(nc1C(N)=O)-c1ccc([C@@H]2CC[C@H](CC(O)=O)CC2)c(Cl)c1 \|r,wU:15.15,18.19,(2.81,-20.05,;4.14,-19.28,;5.48,-20.05,;6.81,-19.28,;8.14,-20.05,;6.81,-17.74,;5.47,-16.97,;4.14,-17.74,;2.81,-16.97,;1.47,-17.73,;2.81,-15.43,;8.14,-16.98,;8.14,-15.43,;9.47,-14.66,;10.8,-15.42,;12.14,-14.65,;13.47,-15.42,;14.8,-14.65,;14.8,-13.11,;16.14,-12.34,;17.47,-13.11,;18.8,-12.34,;17.47,-14.65,;13.47,-12.34,;12.13,-13.12,;10.81,-16.97,;12.14,-17.74,;9.47,-17.75,)\|
BDBM50399683	Cc1nc(C)c(nc1C(N)=O)-c1ccc([C@@H]2CC[C@H](CC(O)=O)CC2)c(F)c1 \|r,wU:15.15,18.19,(58.03,-11.07,;59.36,-10.3,;60.7,-11.07,;62.03,-10.3,;63.37,-11.06,;62.03,-8.76,;60.7,-7.99,;59.36,-8.75,;58.03,-7.98,;56.69,-8.75,;58.03,-6.44,;63.36,-7.99,;63.36,-6.45,;64.69,-5.68,;66.03,-6.44,;67.36,-5.67,;68.7,-6.44,;70.02,-5.67,;70.02,-4.13,;71.36,-3.36,;72.69,-4.13,;74.03,-3.36,;72.69,-5.67,;68.69,-3.36,;67.35,-4.13,;66.03,-7.99,;67.37,-8.76,;64.69,-8.76,)\|
BDBM50399684	Cc1nc(C)c(nc1C(N)=O)-c1ccc(cc1)[C@@H]1CC[C@H](CC(O)=O)CC1 \|r,wU:17.18,20.22,(39.9,-10.55,;41.23,-9.78,;42.57,-10.55,;43.9,-9.77,;45.24,-10.54,;43.9,-8.24,;42.57,-7.47,;41.23,-8.23,;39.9,-7.46,;38.56,-8.23,;39.9,-5.92,;45.23,-7.47,;46.56,-8.24,;47.9,-7.47,;47.9,-5.92,;46.56,-5.16,;45.23,-5.93,;49.23,-5.15,;50.57,-5.92,;51.89,-5.15,;51.89,-3.61,;53.23,-2.84,;54.56,-3.61,;55.9,-2.84,;54.56,-5.15,;50.56,-2.84,;49.22,-3.61,)\|
BDBM50399685	Cc1nc(C)c(nc1C(N)=O)-c1ccc([C@H]2CC[C@H](CC(O)=O)CC2)c(Cl)c1 \|r,wU:15.15,wD:18.19,(21.76,-10.54,;23.09,-9.77,;24.44,-10.54,;25.76,-9.77,;27.1,-10.53,;25.76,-8.23,;24.43,-7.46,;23.09,-8.23,;21.76,-7.45,;20.43,-8.22,;21.76,-5.91,;27.09,-7.46,;27.09,-5.92,;28.42,-5.15,;29.76,-5.91,;31.09,-5.14,;31.08,-3.6,;32.42,-2.83,;33.76,-3.6,;35.09,-2.83,;36.42,-3.6,;37.76,-2.83,;36.42,-5.14,;33.75,-5.14,;32.43,-5.91,;29.76,-7.46,;31.1,-8.23,;28.43,-8.23,)\|
BDBM50399686	Cc1nc(C)c(nc1C(N)=O)-c1ccc([C@H]2CC[C@H](CC(O)=O)CC2)c(F)c1 \|r,wU:15.15,wD:18.19,(3.62,-10.18,;4.96,-9.41,;6.3,-10.18,;7.63,-9.41,;8.96,-10.18,;7.62,-7.87,;6.29,-7.1,;4.96,-7.87,;3.62,-7.1,;2.29,-7.86,;3.63,-5.56,;8.95,-7.11,;8.96,-5.56,;10.29,-4.79,;11.62,-5.55,;12.95,-4.78,;12.95,-3.25,;14.28,-2.47,;15.62,-3.24,;16.95,-2.47,;18.29,-3.24,;19.62,-2.47,;18.29,-4.78,;15.62,-4.78,;14.29,-5.55,;11.63,-7.1,;12.96,-7.87,;10.29,-7.88,)\|
BDBM50399687	Cc1nc(C)c(nc1C(N)=O)-c1ccc(cc1)[C@H]1CC[C@H](CCC(O)=O)CC1 \|r,wU:17.18,wD:20.22,(43.96,-49.43,;45.3,-48.66,;46.64,-49.43,;47.97,-48.65,;49.3,-49.42,;47.97,-47.12,;46.63,-46.35,;45.3,-47.11,;43.97,-46.34,;42.63,-47.11,;43.97,-44.8,;49.3,-46.35,;50.63,-47.12,;51.97,-46.35,;51.96,-44.8,;50.63,-44.04,;49.3,-44.81,;53.3,-44.03,;53.29,-42.49,;54.63,-41.72,;55.96,-42.49,;57.3,-41.72,;58.63,-42.49,;59.96,-41.72,;61.3,-42.49,;59.96,-40.18,;55.96,-44.03,;54.63,-44.8,)\|
BDBM50399688	Cc1nc(C)c(nc1C(N)=O)-c1ccc(cc1)[C@H]1CC[C@H](Cc2nnn[nH]2)CC1 \|r,wU:17.18,wD:20.22,(23.91,-49.49,;25.24,-48.72,;26.58,-49.49,;27.91,-48.72,;29.24,-49.48,;27.91,-47.18,;26.57,-46.41,;25.24,-47.17,;23.91,-46.4,;22.57,-47.17,;23.91,-44.86,;29.24,-46.41,;30.57,-47.18,;31.91,-46.41,;31.9,-44.86,;30.57,-44.1,;29.24,-44.87,;33.24,-44.09,;33.23,-42.55,;34.57,-41.78,;35.9,-42.55,;37.24,-41.78,;38.57,-42.55,;38.73,-44.08,;40.24,-44.4,;41.01,-43.07,;39.98,-41.92,;35.9,-44.09,;34.57,-44.86,)\|
BDBM50399689	Cc1nc(C)c(nc1C(N)=O)-c1ccc(cc1)[C@H]1CC[C@H](CC(=O)NS(C)(=O)=O)CC1 \|r,wU:17.18,wD:20.22,(3.84,-47.51,;5.17,-46.74,;6.52,-47.51,;7.84,-46.74,;9.18,-47.51,;7.84,-45.21,;6.51,-44.43,;5.18,-45.2,;3.84,-44.43,;2.51,-45.2,;3.84,-42.89,;9.17,-44.44,;10.51,-45.21,;11.84,-44.44,;11.84,-42.89,;10.5,-42.12,;9.17,-42.89,;13.17,-42.12,;13.16,-40.58,;14.5,-39.81,;15.84,-40.58,;17.17,-39.81,;18.51,-40.58,;18.51,-42.12,;19.84,-39.81,;21.17,-40.58,;22.51,-39.81,;20.77,-42.06,;21.93,-41.91,;15.84,-42.12,;14.51,-42.89,)\|
BDBM50399690	CC(C)(NC(=O)C[C@H]1CC[C@@H](CC1)c1ccc(cc1)-c1cncc(n1)C(N)=O)C(O)=O \|r,wU:10.13,wD:7.6,(75.46,-31.72,;76.24,-30.39,;77,-31.72,;74.9,-29.62,;73.57,-30.39,;73.57,-31.93,;72.24,-29.62,;70.9,-30.39,;69.57,-29.62,;68.23,-30.39,;68.24,-31.93,;69.57,-32.7,;70.9,-31.93,;66.9,-32.7,;66.91,-34.25,;65.57,-35.02,;64.24,-34.25,;64.24,-32.71,;65.57,-31.93,;62.91,-35.02,;62.91,-36.55,;61.58,-37.32,;60.24,-36.55,;60.24,-35.01,;61.57,-34.24,;58.91,-34.24,;57.57,-35.01,;58.91,-32.7,;77.57,-29.62,;78.91,-30.39,;77.57,-28.08,)\|
BDBM50399691	Cc1nc(C)c(nc1C(N)=O)-c1ccc(cc1)[C@H]1CC[C@H](CC(=O)NC(C)(C)C(O)=O)CC1 \|r,wU:17.18,wD:20.22,(37.91,-37.31,;39.25,-36.54,;40.59,-37.31,;41.92,-36.54,;43.25,-37.3,;41.92,-35,;40.58,-34.23,;39.25,-35,;37.92,-34.22,;36.58,-34.99,;37.92,-32.69,;43.25,-34.23,;44.58,-35,;45.92,-34.23,;45.91,-32.68,;44.58,-31.92,;43.25,-32.69,;47.25,-31.91,;47.24,-30.37,;48.58,-29.6,;49.91,-30.37,;51.25,-29.6,;52.58,-30.37,;52.58,-31.91,;53.91,-29.6,;55.25,-30.37,;54.47,-31.7,;56.01,-31.7,;56.58,-29.6,;57.91,-30.37,;56.58,-28.06,;49.91,-31.91,;48.58,-32.68,)\|
BDBM50399692	NC(=O)C[C@H]1CC[C@@H](CC1)c1ccc(cc1)-c1cncc(n1)C(N)=O \|r,wU:7.10,wD:4.3,(36.86,-29.48,;35.53,-30.25,;35.53,-31.79,;34.2,-29.48,;32.86,-30.25,;31.53,-29.49,;30.19,-30.26,;30.2,-31.79,;31.53,-32.56,;32.86,-31.8,;28.86,-32.57,;28.87,-34.12,;27.53,-34.89,;26.2,-34.12,;26.2,-32.57,;27.53,-31.8,;24.87,-34.89,;24.87,-36.42,;23.54,-37.19,;22.2,-36.42,;22.2,-34.88,;23.53,-34.11,;20.87,-34.11,;19.53,-34.88,;20.87,-32.57,)\|
BDBM50399693	Cc1nc(C)c(nc1C(N)=O)-c1ccc(cc1)[C@H]1CC[C@H](CC(N)=O)CC1 \|r,wU:17.18,wD:20.22,(3.49,-36.66,;4.82,-35.89,;6.16,-36.66,;7.49,-35.89,;8.83,-36.66,;7.49,-34.35,;6.16,-33.58,;4.82,-34.35,;3.49,-33.58,;2.16,-34.34,;3.49,-32.04,;8.82,-33.59,;10.16,-34.36,;11.49,-33.58,;11.49,-32.03,;10.15,-31.27,;8.82,-32.04,;12.82,-31.26,;12.81,-29.73,;14.15,-28.95,;15.49,-29.72,;16.82,-28.95,;18.15,-29.72,;19.49,-28.95,;18.15,-31.26,;15.48,-31.26,;14.16,-32.03,)\|
BDBM50399694	NC(=O)c1cncc(n1)-c1ccc(cc1)[C@H]1CC[C@H](CCO)CC1 \|r,wU:15.16,wD:18.20,(57.84,-21.32,;59.18,-20.56,;59.18,-19.02,;60.51,-21.33,;60.51,-22.87,;61.85,-23.64,;63.18,-22.87,;63.18,-21.33,;61.84,-20.56,;64.51,-20.56,;65.84,-21.34,;67.18,-20.56,;67.17,-19.01,;65.84,-18.25,;64.51,-19.02,;68.51,-18.24,;68.5,-16.71,;69.83,-15.93,;71.17,-16.7,;72.5,-15.93,;73.84,-16.7,;75.17,-15.93,;71.17,-18.24,;69.84,-19.01,)\|
BDBM50399695	Cc1nc(C)c(nc1C(N)=O)-c1ccc(cc1)[C@H]1CC[C@H](CCO)CC1 \|r,wU:17.18,wD:20.22,(37.77,-23.43,;39.1,-22.65,;40.44,-23.43,;41.77,-22.65,;43.1,-23.42,;41.77,-21.12,;40.43,-20.35,;39.1,-21.11,;37.77,-20.34,;36.43,-21.11,;37.77,-18.8,;43.1,-20.35,;44.43,-21.12,;45.77,-20.35,;45.76,-18.8,;44.43,-18.04,;43.1,-18.81,;47.1,-18.03,;47.09,-16.49,;48.43,-15.72,;49.76,-16.49,;51.1,-15.72,;52.43,-16.49,;53.76,-15.72,;49.76,-18.03,;48.43,-18.8,)\|
BDBM50399696	Cc1nc(-c2ccccc2)c(nc1C(N)=O)-c1ccc(cc1)[C@H]1CC[C@H](CC(O)=O)CC1 \|r,wU:22.24,wD:25.28,(19.12,-23.51,;20.45,-22.74,;21.79,-23.51,;23.12,-22.74,;24.45,-23.5,;24.45,-25.05,;25.78,-25.81,;27.12,-25.04,;27.11,-23.49,;25.78,-22.73,;23.12,-21.21,;21.78,-20.43,;20.45,-21.2,;19.12,-20.43,;17.78,-21.2,;19.12,-18.89,;24.45,-20.44,;25.78,-21.21,;27.12,-20.44,;27.11,-18.88,;25.78,-18.12,;24.45,-18.89,;28.45,-18.11,;28.44,-16.58,;29.78,-15.81,;31.11,-16.57,;32.45,-15.8,;33.78,-16.57,;35.11,-15.8,;33.78,-18.11,;31.11,-18.12,;29.78,-18.88,)\|
BDBM50399697	CC(C)c1nc(C)c(nc1-c1ccc(cc1)[C@H]1CC[C@H](CC(O)=O)CC1)C(N)=O \|r,wU:16.17,wD:19.21,(9.46,-23.48,;9.46,-21.94,;10.79,-21.16,;8.12,-21.17,;6.8,-21.94,;5.45,-21.17,;4.12,-21.94,;5.46,-19.63,;6.79,-18.86,;8.12,-19.63,;9.45,-18.87,;10.79,-19.64,;12.12,-18.86,;12.12,-17.31,;10.78,-16.55,;9.46,-17.32,;13.45,-16.54,;13.44,-15.01,;14.78,-14.23,;16.12,-15,;17.45,-14.23,;18.79,-15,;20.12,-14.23,;18.79,-16.54,;16.12,-16.54,;14.79,-17.31,;4.12,-18.86,;2.79,-19.62,;4.12,-17.32,)\|
BDBM50399698	CCc1nc(C)c(nc1-c1ccc(cc1)[C@H]1CC[C@H](CC(O)=O)CC1)C(N)=O \|r,wU:15.16,wD:18.20,(67.34,-12.09,;67.33,-10.55,;66,-9.78,;64.67,-10.55,;63.33,-9.78,;61.99,-10.55,;63.33,-8.24,;64.66,-7.47,;66,-8.25,;67.33,-7.48,;68.66,-8.25,;70,-7.48,;69.99,-5.93,;68.66,-5.16,;67.33,-5.93,;71.33,-5.16,;71.32,-3.62,;72.65,-2.85,;73.99,-3.62,;75.32,-2.85,;76.66,-3.62,;77.99,-2.85,;76.66,-5.16,;73.99,-5.16,;72.66,-5.93,;62,-7.47,;60.66,-8.24,;62,-5.93,)\|
BDBM50399699	NC(=O)c1nc(cnc1N)-c1ccc(cc1)[C@H]1CC[C@H](CC(O)=O)CC1 \|r,wU:16.17,wD:19.21,(40.87,-7.5,;42.21,-6.73,;42.21,-5.19,;43.54,-7.5,;44.88,-6.73,;46.21,-7.51,;46.21,-9.04,;44.88,-9.81,;43.54,-9.04,;42.21,-9.81,;47.54,-6.74,;48.87,-7.51,;50.21,-6.74,;50.21,-5.19,;48.87,-4.42,;47.54,-5.2,;51.54,-4.42,;51.53,-2.88,;52.87,-2.11,;54.2,-2.88,;55.54,-2.11,;56.87,-2.88,;58.21,-2.11,;56.87,-4.42,;54.2,-4.42,;52.88,-5.19,)\|
BDBM50399700	Cc1nc(-c2ccccc2)c(nc1-c1ccc(cc1)[C@H]1CC[C@H](CC(O)=O)CC1)C(N)=O \|r,wU:19.21,wD:22.25,(28.61,-10.63,;27.27,-9.87,;25.94,-10.64,;24.6,-9.87,;23.28,-10.64,;21.94,-9.87,;20.61,-10.64,;20.61,-12.18,;21.95,-12.95,;23.28,-12.18,;24.6,-8.33,;25.94,-7.56,;27.27,-8.33,;28.6,-7.56,;29.94,-8.34,;31.27,-7.56,;31.27,-6.01,;29.93,-5.25,;28.6,-6.02,;32.6,-5.24,;32.59,-3.7,;33.93,-2.93,;35.27,-3.7,;36.6,-2.93,;37.93,-3.7,;39.27,-2.93,;37.93,-5.24,;35.26,-5.24,;33.94,-6.01,;23.27,-7.56,;21.94,-8.32,;23.27,-6.02,)\|
BDBM50399701	CC(C)c1nc(C)c(nc1C(N)=O)-c1ccc(cc1)[C@H]1CC[C@H](CC(O)=O)CC1 \|r,wU:19.20,wD:22.24,(2.81,-9.81,;4.14,-10.58,;4.14,-12.12,;5.48,-9.81,;6.82,-10.58,;8.15,-9.81,;9.48,-10.57,;8.15,-8.27,;6.81,-7.5,;5.48,-8.26,;4.15,-7.49,;2.81,-8.26,;4.15,-5.95,;9.48,-7.5,;10.81,-8.27,;12.15,-7.5,;12.14,-5.95,;10.81,-5.19,;9.48,-5.96,;13.48,-5.18,;13.47,-3.64,;14.8,-2.87,;16.14,-3.64,;17.47,-2.87,;18.81,-3.64,;20.14,-2.87,;18.81,-5.18,;16.14,-5.18,;14.81,-5.95,)\|
BDBM50399702	CCc1nc(C)c(nc1C(N)=O)-c1ccc(cc1)[C@H]1CC[C@H](CC(O)=O)CC1 \|r,wU:18.19,wD:21.23,(61.37,-52.27,;62.71,-53.04,;64.04,-52.27,;65.38,-53.04,;66.71,-52.27,;68.05,-53.04,;66.71,-50.74,;65.38,-49.96,;64.04,-50.73,;62.71,-49.96,;61.38,-50.73,;62.71,-48.42,;68.04,-49.97,;69.38,-50.74,;70.71,-49.97,;70.71,-48.42,;69.37,-47.65,;68.04,-48.42,;72.04,-47.65,;72.03,-46.11,;73.37,-45.34,;74.71,-46.11,;76.04,-45.34,;77.37,-46.11,;78.71,-45.34,;77.37,-47.65,;74.7,-47.65,;73.38,-48.42,)\|
BDBM50399703	Cc1nc(C(F)F)c(nc1-c1ccc(cc1)[C@H]1CC[C@H](CC(O)=O)CC1)C(N)=O \|r,wU:16.17,wD:19.21,(46.43,-53.65,;45.1,-52.89,;43.77,-53.66,;42.43,-52.89,;41.1,-53.66,;39.76,-52.89,;41.1,-55.2,;42.43,-51.35,;43.76,-50.58,;45.1,-51.35,;46.43,-50.58,;47.76,-51.35,;49.1,-50.58,;49.09,-49.03,;47.76,-48.27,;46.43,-49.04,;50.43,-48.26,;50.42,-46.72,;51.76,-45.95,;53.09,-46.72,;54.43,-45.95,;55.76,-46.72,;57.09,-45.95,;55.76,-48.26,;53.09,-48.26,;51.76,-49.03,;41.1,-50.57,;39.76,-51.34,;41.1,-49.03,)\|
BDBM50399704	Cc1ccc(nc1-c1ccc(cc1)[C@H]1CC[C@H](CC(O)=O)CC1)C(N)=O \|r,wU:13.14,wD:16.18,(28.24,-53.18,;26.91,-52.41,;25.58,-53.18,;24.24,-52.41,;24.24,-50.87,;25.57,-50.1,;26.91,-50.88,;28.24,-50.11,;29.57,-50.88,;30.91,-50.11,;30.9,-48.56,;29.57,-47.79,;28.24,-48.56,;32.24,-47.79,;32.23,-46.25,;33.56,-45.48,;34.9,-46.25,;36.23,-45.48,;37.57,-46.25,;38.9,-45.48,;37.57,-47.79,;34.9,-47.79,;33.57,-48.56,;22.91,-50.1,;21.57,-50.87,;22.91,-48.56,)\|
BDBM50399705	NC(=O)c1cccc(n1)-c1ccc(cc1)[C@H]1CC[C@H](CC(O)=O)CC1 \|r,wU:15.16,wD:18.20,(2.38,-50.34,;3.72,-49.58,;3.72,-48.04,;5.05,-50.35,;5.05,-51.89,;6.39,-52.66,;7.72,-51.89,;7.72,-50.35,;6.38,-49.58,;9.05,-49.58,;10.38,-50.35,;11.72,-49.58,;11.71,-48.03,;10.38,-47.27,;9.05,-48.04,;13.05,-47.26,;13.04,-45.73,;14.38,-44.95,;15.71,-45.72,;17.05,-44.95,;18.38,-45.72,;19.71,-44.95,;18.38,-47.26,;15.71,-47.26,;14.38,-48.03,)\|
BDBM50399706	NC(=O)c1cncc(c1)-c1ccc(cc1)[C@H]1CC[C@H](CC(O)=O)CC1 \|r,wU:15.16,wD:18.20,(60.91,-40.47,;62.24,-39.7,;62.25,-38.16,;63.58,-40.47,;63.57,-42.01,;64.92,-42.78,;66.24,-42.01,;66.24,-40.48,;64.91,-39.7,;67.57,-39.71,;68.91,-40.48,;70.24,-39.71,;70.24,-38.16,;68.9,-37.39,;67.58,-38.16,;71.57,-37.39,;71.56,-35.85,;72.9,-35.08,;74.24,-35.85,;75.57,-35.08,;76.91,-35.85,;78.24,-35.08,;76.91,-37.39,;74.24,-37.39,;72.91,-38.16,)\|
BDBM50399707	Cc1ncc(nc1-c1ccc(cc1)[C@H]1CC[C@H](CC(O)=O)CC1)C(N)=S \|r,wU:13.14,wD:16.18,(45.97,-43.39,;44.63,-42.63,;43.3,-43.4,;41.96,-42.63,;41.96,-41.09,;43.3,-40.32,;44.63,-41.09,;45.96,-40.32,;47.3,-41.09,;48.63,-40.32,;48.63,-38.77,;47.29,-38.01,;45.96,-38.78,;49.96,-38,;49.95,-36.46,;51.29,-35.69,;52.63,-36.46,;53.96,-35.69,;55.29,-36.46,;56.63,-35.69,;55.29,-38,;52.62,-38,;51.3,-38.77,;40.63,-40.31,;39.3,-41.08,;40.63,-38.77,)\|
BDBM50399708	NC(=N)c1cncc(n1)-c1ccc(cc1)[C@H]1CC[C@H](CC(O)=O)CC1 \|r,wU:15.16,wD:18.20,(1.92,-40.08,;3.25,-39.32,;3.25,-37.78,;4.58,-40.09,;4.58,-41.63,;5.92,-42.4,;7.25,-41.63,;7.25,-40.09,;5.92,-39.32,;8.58,-39.33,;9.92,-40.1,;11.25,-39.32,;11.25,-37.77,;9.91,-37.01,;8.58,-37.78,;12.58,-37,;12.57,-35.47,;13.91,-34.69,;15.25,-35.46,;16.58,-34.69,;17.91,-35.46,;19.25,-34.69,;17.91,-37,;15.24,-37,;13.92,-37.77,)\|
BDBM50399709	Cc1ncc(nc1C(N)=O)-c1ccc(cc1)[C@H]1CC[C@H](CC(O)=O)CC1 \|r,wU:16.17,wD:19.21,(3.36,-22.24,;4.69,-21.47,;6.03,-22.24,;7.36,-21.46,;7.36,-19.93,;6.03,-19.16,;4.69,-19.92,;3.36,-19.15,;2.03,-19.92,;3.36,-17.61,;8.69,-19.16,;10.02,-19.93,;11.36,-19.16,;11.36,-17.61,;10.02,-16.85,;8.69,-17.62,;12.69,-16.84,;12.68,-15.3,;14.02,-14.53,;15.36,-15.3,;16.69,-14.53,;18.02,-15.3,;19.36,-14.53,;18.02,-16.84,;15.35,-16.84,;14.03,-17.61,)\|
BDBM50399710	Cc1nc(C)c(nc1C(N)=O)-c1ccc(cc1)[C@H]1CC[C@H](CC(O)=O)CC1 \|r,wU:17.18,wD:20.22,(61.46,-10.56,;62.79,-9.79,;64.13,-10.56,;65.46,-9.79,;66.8,-10.56,;65.46,-8.26,;64.13,-7.48,;62.79,-8.25,;61.46,-7.48,;60.12,-8.25,;61.46,-5.94,;66.79,-7.49,;68.12,-8.26,;69.46,-7.49,;69.46,-5.94,;68.12,-5.17,;66.79,-5.94,;70.79,-5.16,;70.78,-3.63,;72.12,-2.86,;73.45,-3.62,;74.79,-2.85,;76.12,-3.62,;77.46,-2.85,;76.12,-5.16,;73.45,-5.17,;72.13,-5.93,)\|
BDBM50399711	NC(=O)c1cncc(n1)-c1ccc(cc1)[C@H]1CC[C@H](CC(O)=O)CC1 \|r,wU:15.16,wD:18.20,(41.53,-9,;42.87,-8.23,;42.87,-6.69,;44.2,-9,;44.2,-10.54,;45.54,-11.32,;46.87,-10.54,;46.87,-9.01,;45.53,-8.24,;48.2,-8.24,;49.53,-9.01,;50.87,-8.24,;50.86,-6.69,;49.53,-5.93,;48.2,-6.7,;52.2,-5.92,;52.19,-4.38,;53.53,-3.61,;54.86,-4.38,;56.2,-3.61,;57.53,-4.38,;58.86,-3.61,;57.53,-5.92,;54.86,-5.92,;53.53,-6.69,)\|
BDBM50399712	Cc1ncc(nc1-c1ccc(cc1)[C@H]1CC[C@H](CC(O)=O)CC1)C(N)=O \|r,wU:13.14,wD:16.18,(28.53,-10.23,;27.19,-9.46,;25.86,-10.23,;24.52,-9.46,;24.52,-7.92,;25.86,-7.15,;27.19,-7.93,;28.52,-7.16,;29.86,-7.93,;31.19,-7.16,;31.19,-5.61,;29.85,-4.84,;28.52,-5.62,;32.52,-4.84,;32.51,-3.3,;33.85,-2.53,;35.19,-3.3,;36.52,-2.53,;37.85,-3.3,;39.19,-2.53,;37.85,-4.84,;35.18,-4.84,;33.86,-5.61,;23.19,-7.15,;21.86,-7.92,;23.19,-5.61,)\|
BDBM50399713	Cc1ncc(nc1-c1ccc(cc1)[C@H]1CC[C@@H](CC1)C(O)=O)C(N)=O \|r,wU:13.14,wD:16.21,(8.54,-10.7,;7.21,-9.94,;5.88,-10.71,;4.54,-9.94,;4.54,-8.4,;5.87,-7.63,;7.2,-8.4,;8.53,-7.63,;9.87,-8.4,;11.21,-7.63,;11.2,-6.08,;9.87,-5.32,;8.54,-6.09,;12.53,-5.31,;12.52,-3.77,;13.86,-3,;15.2,-3.77,;15.2,-5.31,;13.87,-6.08,;16.53,-3,;17.86,-3.77,;16.53,-1.46,;3.2,-7.62,;1.87,-8.39,;3.21,-6.08,)\|
BDBM50399714	Cc1nc(C)c(nc1C(N)=O)-c1ccc(cc1)C12CCC(CC1)(CC2)C(O)=O
BDBM50399715	Cc1nc(C)c(nc1C(N)=O)-c1ccc(cc1)C12CCC(Cc3nnn[nH]3)(CC1)CC2
BDBM50399716	Cc1nc(C)c(nc1C(N)=O)-c1ccc(cc1)C12CCC(CC(O)=O)(CC1)CC2
BDBM276750	CCOc1cccnc1Oc1cncc(c1)-c1ncc(cn1)C(=O)N[C@H]1CCOC1 \|r\|
BDBM276748	CCOc1cccnc1Oc1cncc(c1)-c1ncc(cn1)C(=O)NC(C)(C)CO
BDBM50402748	CC(C)(C)c1ccc(OCc2nc3ccc(cc3[nH]2)C(=O)NCc2ccco2)cc1
BDBM50402749	O=C(NCc1ccco1)c1ccc2nc(COc3ccc(cc3)-c3ccccc3)[nH]c2c1
BDBM50402750	O=C(NCc1ccco1)c1ccc2nc(COc3ccccc3)[nH]c2c1
BDBM50402751	O=C(NCc1cccs1)c1ccc2nc(COc3ccc(cc3)C34CC5CC(CC(C5)C3)C4)[nH]c2c1 \|TLB:20:23:26.25.30:28,THB:24:25:28:32.23.31,24:23:26.25.30:28,31:23:26:30.29.28,31:29:26:32.24.23,20:23:26:30.29.28\|
BDBM50402752	O=C(NC[C@@H]1CCCO1)c1ccc2nc(COc3ccc(cc3)C34CC5CC(CC(C5)C3)C4)[nH]c2c1 \|r,TLB:20:23:26.25.30:28,THB:24:25:28:32.23.31,24:23:26.25.30:28,31:23:26:30.29.28,31:29:26:32.24.23,20:23:26:30.29.28\|
BDBM50402753	O=C(NC[C@H]1CCCO1)c1ccc2nc(COc3ccc(cc3)C34CC5CC(CC(C5)C3)C4)[nH]c2c1 \|r,TLB:20:23:26.25.30:28,THB:24:25:28:32.23.31,24:23:26.25.30:28,31:23:26:30.29.28,31:29:26:32.24.23,20:23:26:30.29.28\|
BDBM50402754	Cc1ccc(CNC(=O)c2ccc3nc(COc4ccc(cc4)C45CC6CC(CC(C6)C4)C5)[nH]c3c2)o1 \|TLB:20:23:26.25.30:28,THB:24:25:28:32.23.31,24:23:26.25.30:28,31:23:26:30.29.28,31:29:26:32.24.23,20:23:26:30.29.28\|
BDBM50402755	Cc1ccoc1CNC(=O)c1ccc2nc(COc3ccc(cc3)C34CC5CC(CC(C5)C3)C4)[nH]c2c1 \|TLB:21:24:27.26.31:29,THB:25:26:29:33.24.32,25:24:27.26.31:29,32:24:27:31.30.29,32:30:27:33.25.24,21:24:27:31.30.29\|
BDBM50402756	O=C(NCc1ccco1)c1ccc2nc(COc3ccc(cc3)C34CC5CC(CC(C5)C3)C4)[nH]c2c1 \|TLB:20:23:26.25.30:28,THB:24:25:28:32.23.31,24:23:26.25.30:28,31:23:26:30.29.28,31:29:26:32.24.23,20:23:26:30.29.28\|
BDBM50402757	O=C(NCc1ccccn1)c1ccc2nc(COc3ccc(cc3)C34CC5CC(CC(C5)C3)C4)[nH]c2c1 \|TLB:21:24:27.26.31:29,THB:25:26:29:33.24.32,25:24:27.26.31:29,32:24:27:31.30.29,32:30:27:33.25.24,21:24:27:31.30.29\|
BDBM50402758	O=C(NCc1ccccc1)c1ccc2nc(COc3ccc(cc3)C34CC5CC(CC(C5)C3)C4)[nH]c2c1 \|TLB:21:24:27.26.31:29,THB:25:26:29:33.24.32,25:24:27.26.31:29,32:24:27:31.30.29,32:30:27:33.25.24,21:24:27:31.30.29\|
BDBM50402759	CC(C)c1cccc(C(C)C)c1NC(=O)c1ccc2nc(COc3ccc(cc3)C34CC5CC(CC(C5)C3)C4)[nH]c2c1 \|TLB:26:29:32.31.36:34,THB:30:31:34:38.29.37,30:29:32.31.36:34,37:29:32:36.35.34,37:35:32:38.30.29,26:29:32:36.35.34\|
BDBM50402760	O=C(Nc1ccccc1)c1ccc2nc(COc3ccc(cc3)C34CC5CC(CC(C5)C3)C4)[nH]c2c1 \|TLB:20:23:26.25.30:28,THB:24:25:28:32.23.31,24:23:26.25.30:28,31:23:26:30.29.28,31:29:26:32.24.23,20:23:26:30.29.28\|
BDBM50402761	O=C(N1CCCCC1)c1ccc2nc(COc3ccc(cc3)C34CC5CC(CC(C5)C3)C4)[nH]c2c1 \|TLB:19:22:25.24.29:27,THB:23:24:27:31.22.30,23:22:25.24.29:27,30:22:25:29.28.27,30:28:25:31.23.22,19:22:25:29.28.27\|
BDBM50402762	O=C(N1CCCC1)c1ccc2nc(COc3ccc(cc3)C34CC5CC(CC(C5)C3)C4)[nH]c2c1 \|TLB:18:21:24.23.28:26,THB:22:23:26:30.21.29,22:21:24.23.28:26,29:21:24:28.27.26,29:27:24:30.22.21,18:21:24:28.27.26\|
BDBM50402763	CC(C)NC(=O)c1ccc2nc(COc3ccc(cc3)C34CC5CC(CC(C5)C3)C4)[nH]c2c1 \|TLB:17:20:23.22.27:25,THB:21:22:25:29.20.28,21:20:23.22.27:25,28:20:23:27.26.25,28:26:23:29.21.20,17:20:23:27.26.25\|
BDBM50402764	CN(C)C(=O)c1ccc2nc(COc3ccc(cc3)C34CC5CC(CC(C5)C3)C4)[nH]c2c1 \|TLB:16:19:22.21.26:24,THB:20:21:24:28.19.27,20:19:22.21.26:24,27:19:22:26.25.24,27:25:22:28.20.19,16:19:22:26.25.24\|
BDBM50402765	NC(=O)c1ccc2nc(COc3ccc(cc3)C34CC5CC(CC(C5)C3)C4)[nH]c2c1 \|TLB:14:17:20.19.24:22,THB:18:19:22:26.17.25,18:17:20.19.24:22,25:17:20:24.23.22,25:23:20:26.18.17,14:17:20:24.23.22\|
BDBM50402766	OC(=O)c1ccc2nc(COc3ccc(cc3)C34CC5CC(CC(C5)C3)C4)[nH]c2c1 \|TLB:14:17:20.19.24:22,THB:18:19:22:26.17.25,18:17:20.19.24:22,25:17:20:24.23.22,25:23:20:26.18.17,14:17:20:24.23.22\|
BDBM50402767	COC(=O)c1ccc2nc(COc3ccc(cc3)C34CC5CC(CC(C5)C3)C4)[nH]c2c1 \|TLB:15:18:21.20.25:23,THB:19:20:23:27.18.26,19:18:21.20.25:23,26:18:21:25.24.23,26:24:21:27.19.18,15:18:21:25.24.23\|
BDBM50433269	CC[C@]1(C)NC(=O)c2cc(ccc2NC1=O)S(=O)(=O)Nc1ccc(F)cc1F \|r\|
BDBM50433270	CCC1(C)NC(=O)c2cc(ccc2NC1=O)S(=O)(=O)Nc1ccc(OC)cc1
BDBM50433271	CCC1(C)NC(=O)c2cc(ccc2NC1=O)S(=O)(=O)Nc1ccccc1Cl
BDBM50433272	CCC1(C)NC(=O)c2cc(ccc2NC1=O)S(=O)(=O)Nc1ccc(Cl)cc1
BDBM50433273	CCC1(C)NC(=O)c2cc(ccc2NC1=O)S(=O)(=O)Nc1ccccc1
BDBM50433274	CC[C@]1(C)NC(=O)c2cc(ccc2NC1=O)S(=O)(=O)Nc1ccc(OC(F)F)cc1 \|r\|
BDBM50433275	CC[C@]1(C)NC(=O)c2cc(ccc2NC1=O)S(=O)(=O)Nc1ccc(cc1)C(F)(F)F \|r\|
BDBM50433276	CCC1(CC)CNc2ccc(cc2C(=O)N1)S(=O)(=O)Nc1ccc(F)cc1F
BDBM50433277	CCC1(C)N(C)C(=O)c2cc(ccc2NC1=O)S(=O)(=O)Nc1ccc(F)cc1F
BDBM50433278	CCC1(C)NC(=O)c2cc(ccc2N(C)C1=O)S(=O)(=O)Nc1ccc(Cl)cc1
BDBM50433279	CCC1(C)NC(=O)c2cc(ccc2NC1=O)S(=O)(=O)N(C)c1ccccc1
BDBM50429020	Cc1c(oc2ccc(cc12)-c1ccccc1)C(=O)Nc1ccc(N2CCC(COc3cccc(c3)C(O)=O)CC2)c(F)c1
BDBM50429021	Cc1c(oc2ccc(cc12)-c1ccccc1)C(=O)Nc1ccc(cc1)N1CCC(COc2cccc(c2)C(O)=O)CC1
BDBM50429022	Cc1c(oc2ccc(cc12)-c1ccccc1)C(=O)Nc1cnc(nc1)N1CCC(COc2cccc(c2)C(O)=O)CC1
BDBM50429023	Cc1c(oc2ccc(cc12)-c1ccccc1)C(=O)Nc1ccc(nc1)N1CCC(COc2cccc(CC(O)=O)c2)CC1
BDBM50429024	Cc1c(oc2ccc(cc12)-c1ccccc1)C(=O)Nc1ccc(nc1)N1CC[C@H](COc2cccc(c2)C(O)=O)C1 \|r\|
BDBM50429025	Cc1c(oc2ccc(cc12)-c1ccccc1)C(=O)Nc1ccc(nc1)N1CC[C@@H](COc2cccc(c2)C(O)=O)C1 \|r\|
BDBM50429026	Cc1c(oc2ccc(cc12)-c1ccccc1)C(=O)Nc1ccc(nc1)N1CCC(CC1)OCc1cccc(c1)C(O)=O
BDBM50429027	Cc1c(oc2ccc(cc12)-c1ccccc1)C(=O)Nc1ccc(nc1)N1CCC(COc2ccc(cc2)C(O)=O)CC1
BDBM50429028	Cc1c(oc2ccc(cc12)-c1ccccc1)C(=O)Nc1ccc(nc1)N1CCC(COc2ccccc2C(O)=O)CC1
BDBM50429029	Cc1c(oc2ccc(cc12)-c1ccccc1)C(=O)Nc1ccc(nc1)N1CCN(CC1)C(=O)Nc1ccccc1C(O)=O
BDBM50429030	Cc1c(oc2c(C)c(C)ccc12)C(=O)Nc1ccc(nc1)N1CCN(CC1)C(=O)Nc1ccccc1F
BDBM50429031	Cc1c(oc2ccc(cc12)-c1ccccc1)C(=O)Nc1ccc(nc1)N1CCN(CC1)C(=O)Nc1ccccc1F
BDBM50429032	Cc1c(oc2ccc(C)cc12)C(=O)Nc1ccc(nc1)N1CCN(CC1)C(=O)Nc1ccccc1F
BDBM50429033	COc1ccc2oc(C(=O)Nc3ccc(nc3)N3CCN(CC3)C(=O)Nc3ccccc3F)c(C)c2c1
BDBM50429034	Cc1c(oc2ccc(F)cc12)C(=O)Nc1ccc(nc1)N1CCN(CC1)C(=O)Nc1ccccc1F
BDBM50429035	FC(F)c1c(oc2ccccc12)C(=O)Nc1ccc(nc1)N1CCN(CC1)C(=O)Nc1ccccc1F
BDBM50429036	FCc1c(oc2ccccc12)C(=O)Nc1ccc(nc1)N1CCN(CC1)C(=O)Nc1ccccc1F
BDBM50429037	Fc1ccccc1NC(=O)N1CCN(CC1)c1ccc(NC(=O)c2cc3ccccc3o2)cn1
BDBM50429038	Cc1c(sc2ccccc12)C(=O)Nc1ccc(nc1)N1CCN(CC1)C(=O)Nc1ccccc1F
BDBM50429039	Cc1c(oc2ccccc12)C(=O)Nc1ccc(nc1)N1CCN(CC1)C(=O)Nc1ccccc1F
BDBM50429040	Cn1c(cc2ccccc12)C(=O)Nc1ccc(nc1)N1CCN(CC1)C(=O)Nc1ccccc1F
BDBM50429041	Fc1ccccc1NC(=O)N1CCN(CC1)c1ccc(NC(=O)c2oc(nc2C(F)(F)F)N2CCCCC2)cn1
BDBM50429008	OC(=O)c1cccc(OCC2CCN(CC2)c2ccc(NC(=O)c3cccc(Oc4ccccc4)c3)cn2)c1
BDBM50429009	Cc1c(oc2ccc(cc12)-c1ccccc1)C(=O)Nc1ccc(nc1)N1CCC(COc2cccc(c2)C(O)=O)CC1
BDBM50429010	CCCCOc1cccc(c1)C(=O)Nc1ccc(nc1)N1CCC(COc2cccc(c2)C(O)=O)CC1
BDBM50429011	OC(=O)c1cccc(OCC2CCN(CC2)c2ccc(NC(=O)c3ccc(OCc4ccccc4)cc3)cn2)c1
BDBM50429012	OC(=O)c1cccc(OCC2CCN(CC2)c2ccc(NC(=O)c3ccc(cc3)C(=O)c3ccccc3)cn2)c1
BDBM50429013	OC(=O)c1cccc(OCC2CCN(CC2)c2ccc(NC(=O)c3ccc(Oc4ccccc4)cc3)cn2)c1
BDBM50429014	OC(=O)c1cccc(OCC2CCN(CC2)c2ccc(NC(=O)c3ccc4ccccc4n3)cn2)c1
BDBM50429015	OC(=O)c1cccc(OCC2CCN(CC2)c2ccc(NC(=O)c3ccc4ccccc4c3)cn2)c1
BDBM50429016	CC1CCCN(C1)c1nc(c(o1)C(=O)Nc1ccc(nc1)N1CCC(COc2cccc(c2)C(O)=O)CC1)C(F)(F)F
BDBM50429017	Cc1c(oc2ccc(cc12)-c1nccs1)C(=O)Nc1ccc(nc1)N1CCC(COc2cccc(c2)C(O)=O)CC1
BDBM50429018	Cc1c(oc2ccc(cc12)-c1ncco1)C(=O)Nc1ccc(nc1)N1CCC(COc2cccc(c2)C(O)=O)CC1
BDBM50429019	Cc1c(sc2ccc(cc12)-c1ccccc1)C(=O)Nc1ccc(nc1)N1CCC(COc2cccc(c2)C(O)=O)CC1
BDBM50442832	CC(C)OC(=O)N1CCN(CC1)c1ccc(NC(=O)c2oc(nc2C(F)(F)F)N2CCCCC2)cn1
BDBM50442833	COCCN(C)c1ccc(NC(=O)c2oc(nc2C(F)(F)F)-c2ccccc2)cn1
BDBM50442834	FC(F)(F)c1nc(oc1C(=O)Nc1ccc(nc1)N1CCN(CC1)c1ncccc1Cl)N1CCCCC1
BDBM50442835	FC(F)(F)c1nc(oc1C(=O)Nc1ccc(nc1)N1CCN(CC1)c1ccccc1)N1CCCCC1
BDBM50442836	FC(F)(F)c1nc(oc1C(=O)Nc1ccc(nc1)N1CCC(CC1)c1ccccc1)N1CCCCC1
BDBM50442837	FC(F)(F)c1nc(oc1C(=O)Nc1ccc(nc1)N1CCCN(CC1)C(=O)Nc1ccccc1Cl)N1CCCCC1
BDBM50442838	FC(F)(F)c1nc(oc1C(=O)Nc1ccc(nc1)N1CCN(CC1)C(=O)Nc1ccccc1Cl)N1CCCCC1
BDBM50442839	FC(F)(F)c1nc(oc1C(=O)Nc1ccc(nc1)N1CCN(CC1)C(=O)NC1CCCC1)N1CCCCC1
BDBM50442840	CC(C)NC(=O)N1CCN(CC1)c1ccc(NC(=O)c2oc(nc2C(F)(F)F)N2CCCCC2)cn1
BDBM50442841	Fc1ccccc1C(=O)N1CCN(CC1)c1ccc(NC(=O)c2oc(nc2C(F)(F)F)N2CCCCC2)cn1
BDBM50442842	FC(F)(F)c1nc(oc1C(=O)Nc1ccc(nc1)N1CCN(CC1)C(=O)C1CCCC1)N1CCCCC1
BDBM50442843	CCC(=O)N1CCN(CC1)c1ccc(NC(=O)c2oc(nc2C(F)(F)F)N2CCCCC2)cn1
BDBM50442844	FC(F)(F)c1nc(oc1C(=O)Nc1ccc(nc1)N1CCN(CC1)C(=O)Oc1ccccc1Cl)N1CCCCC1
BDBM50442845	FC(F)(F)c1nc(oc1C(=O)Nc1ccc(nc1)N1CCN(CC1)C(=O)OC1CCCC1)N1CCCCC1
BDBM50442846	CCOC(=O)N1CCN(CC1)c1ccc(NC(=O)c2oc(nc2C(F)(F)F)N2CCC(C)CC2)cn1
BDBM50442847	CCOC(=O)N1CCN(CC1)c1ccc(NC(=O)c2oc(nc2C(F)(F)F)N2CCCC(C)C2)cn1
BDBM50442848	CCOC(=O)N1CCN(CC1)c1ccc(NC(=O)c2oc(nc2C(F)(F)F)N2CCCCC2C)cn1
BDBM50442849	CCOC(=O)N1CCN(CC1)c1ccc(NC(=O)c2oc(nc2C(F)(F)F)N2CCCCC2)cn1
BDBM50442850	CCOC(=O)C1CCN(CC1)c1ccc(NC(=O)c2oc(nc2C(F)(F)F)N2CCC(F)(F)CC2)cn1
BDBM50442851	CCOC(=O)C1CCN(CC1)c1ccc(NC(=O)c2oc(nc2C(F)(F)F)N2CCCCC2C)cn1
BDBM50442852	CCOC(=O)C1CCN(CC1)c1ccc(NC(=O)c2oc(nc2C(F)(F)F)N2CCCCC2)cn1
BDBM50442853	CCOC(=O)C1CCN(CC1)c1ccc(NC(=O)c2oc(nc2C(F)(F)F)N2CCOCC2)cn1
BDBM50442854	CCOC(=O)C1CCN(CC1)c1ccc(NC(=O)c2oc(nc2C(F)(F)F)N2CCCC2)cn1
BDBM50442855	FC(F)(F)c1nc(oc1C(=O)Nc1ccc(nc1)N1CCN(CC1)C(=O)Nc1ccccc1Cl)-c1ccccc1
BDBM50442856	CCOC(=O)N1CCN(CC1)c1ccc(NC(=O)c2oc(nc2C(F)(F)F)-c2ccccc2)cn1
BDBM50442857	CS(=O)(=O)N1CCN(CC1)c1ccc(NC(=O)c2oc(nc2C(F)(F)F)-c2ccccc2)cn1
BDBM50442858	CCOC(=O)CC1CCN(CC1)c1ccc(NC(=O)c2oc(nc2C(F)(F)F)-c2ccccc2)cn1
BDBM50442859	CCOC(=O)C1CCN(CC1)c1ccc(NC(=O)c2oc(nc2C(F)(F)F)-c2ccccc2)cn1
BDBM50442860	COCCN(C)c1ccc(NC(=O)c2cc(cs2)-c2ccccc2)cn1
BDBM50442861	COCCN(C)c1ccc(NC(=O)c2cc(oc2C)-c2ccccc2)cn1
BDBM50442862	COCCN(C)c1ccc(NC(=O)c2cc(c(s2)C(F)(F)F)-c2ccccc2)cn1
BDBM50442863	COCCN(C)c1ccc(NC(=O)c2cc(-c3ccccc3)n(c2C)-c2ccccc2)cn1
BDBM50438697	Nc1ncnc2OCCN(C3CCCC3)C(=O)c12
BDBM50438701	Cc1ccc(cc1)N1CCOc2ncnc(N)c2C1=O
BDBM50437755	OC(=O)CC1CCC(CC1)c1ccc(cc1)-c1nc2ccc(NC(=O)c3nc(oc3C(F)(F)F)-c3ccccc3Cl)cc2[nH]1 \|(85.43,-36.9,;83.89,-36.91,;83.11,-35.59,;83.13,-38.26,;81.59,-38.27,;80.83,-39.61,;79.29,-39.62,;78.51,-38.3,;79.26,-36.95,;80.8,-36.94,;76.97,-38.32,;76.21,-39.66,;74.67,-39.68,;73.89,-38.35,;74.64,-37.01,;76.18,-36.99,;72.35,-38.37,;71.46,-39.63,;69.99,-39.17,;68.65,-39.95,;67.32,-39.18,;67.32,-37.64,;65.98,-36.88,;64.65,-37.65,;64.65,-39.2,;63.31,-36.89,;61.91,-37.53,;60.87,-36.39,;61.63,-35.05,;63.14,-35.36,;64.29,-34.33,;65.75,-34.8,;63.96,-32.82,;65.37,-33.23,;59.34,-36.56,;58.44,-35.32,;56.91,-35.49,;56.29,-36.9,;57.21,-38.14,;58.73,-37.97,;59.65,-39.2,;68.64,-36.86,;69.98,-37.62,;71.44,-37.14,)\|
BDBM50437756	OC(=O)CC1CCC(CC1)c1ccc(cc1)-c1nc2ccc(NC(=O)c3ccc(cc3)-c3ccccc3)cc2[nH]1 \|(22.7,-17.53,;21.16,-17.54,;20.38,-16.21,;20.4,-18.88,;18.86,-18.89,;18.1,-20.23,;16.57,-20.25,;15.78,-18.92,;16.53,-17.58,;18.08,-17.57,;14.25,-18.95,;13.49,-20.29,;11.95,-20.3,;11.17,-18.98,;11.92,-17.64,;13.45,-17.62,;9.63,-19,;8.74,-20.25,;7.27,-19.79,;5.93,-20.57,;4.6,-19.81,;4.6,-18.27,;3.26,-17.51,;1.93,-18.28,;1.94,-19.82,;.59,-17.52,;.6,-15.98,;-.75,-15.21,;-2.08,-15.99,;-2.08,-17.54,;-.74,-18.29,;-3.41,-15.23,;-3.42,-13.69,;-4.76,-12.93,;-6.09,-13.7,;-6.07,-15.25,;-4.73,-16.01,;5.92,-17.49,;7.26,-18.25,;8.72,-17.76,)\|
BDBM50437757	OC(=O)CC1CCC(CC1)c1ccc(cc1)-c1nc2ccc(NC(=O)c3noc(n3)-c3ccccc3)cc2[nH]1 \|(25.73,-26.26,;24.19,-26.27,;23.41,-24.95,;23.43,-27.61,;21.89,-27.63,;21.13,-28.97,;19.6,-28.98,;18.81,-27.65,;19.56,-26.31,;21.11,-26.3,;17.28,-27.68,;16.52,-29.02,;14.98,-29.04,;14.2,-27.71,;14.95,-26.37,;16.48,-26.35,;12.66,-27.73,;11.77,-28.98,;10.3,-28.52,;8.97,-29.31,;7.63,-28.54,;7.63,-27,;6.29,-26.24,;4.96,-27.01,;4.97,-28.55,;3.63,-26.25,;3.46,-24.72,;1.95,-24.41,;1.19,-25.75,;2.23,-26.89,;-.35,-25.92,;-1.26,-24.67,;-2.79,-24.84,;-3.4,-26.25,;-2.49,-27.5,;-.96,-27.32,;8.95,-26.22,;10.29,-26.98,;11.75,-26.5,)\|
BDBM50437758	OC(=O)CC1CCC(CC1)c1ccc(cc1)-c1nc2ccc(NC(=O)c3cn(nc3C(F)(F)F)-c3ccccc3)cc2[nH]1 \|(86.56,-29.08,;85.02,-29.1,;84.23,-27.77,;84.26,-30.44,;82.72,-30.45,;81.96,-31.79,;80.42,-31.8,;79.64,-30.48,;80.39,-29.13,;81.93,-29.12,;78.1,-30.5,;77.35,-31.84,;75.81,-31.86,;75.02,-30.53,;75.77,-29.19,;77.31,-29.17,;73.49,-30.55,;72.6,-31.81,;71.13,-31.35,;69.79,-32.13,;68.46,-31.36,;68.46,-29.83,;67.12,-29.06,;65.79,-29.84,;65.8,-31.38,;64.45,-29.07,;63.06,-29.71,;62.02,-28.57,;62.78,-27.23,;64.29,-27.55,;65.43,-26.51,;66.9,-26.98,;65.11,-25.01,;66.75,-25.73,;60.49,-28.74,;59.58,-27.5,;58.05,-27.67,;57.43,-29.08,;58.35,-30.32,;59.88,-30.15,;69.78,-29.05,;71.11,-29.81,;72.57,-29.32,)\|
BDBM50436837	CCC(CC)(C#N)c1ccc(cc1)C(=O)Nc1ccc(cc1)-c1cnc(s1)C(=O)N[C@@H](C(C)C)C(O)=O \|r\|
BDBM50437742	CCOC(=O)CC1CCC(CC1)c1ccc(cc1)-c1nc2ccc(cc2[nH]1)[N+]([O-])=O \|(36.64,-37.82,;35.1,-37.83,;34.35,-39.17,;32.81,-39.18,;32.02,-37.85,;32.04,-40.52,;30.5,-40.53,;29.72,-39.21,;28.18,-39.22,;27.42,-40.56,;28.21,-41.89,;29.74,-41.87,;25.89,-40.58,;25.1,-39.25,;23.56,-39.28,;22.8,-40.61,;23.59,-41.94,;25.13,-41.93,;21.27,-40.63,;20.38,-41.89,;18.91,-41.43,;17.57,-42.21,;16.23,-41.45,;16.23,-39.91,;17.56,-39.13,;18.89,-39.89,;20.36,-39.4,;14.89,-39.14,;14.89,-37.6,;13.56,-39.91,)\|
BDBM50436838	CC(C)[C@H](NC(=O)c1ncc(s1)-c1ccc(NC(=O)c2ccc(cc2)C(C)(C)C#N)cc1)C(O)=O \|r\|
BDBM50436839	CCCCc1ccc(nc1)C(=O)Nc1ccc(cc1)-c1cnc(s1)C(=O)N[C@@H](C(C)C)C(O)=O \|r\|
BDBM50437743	Cc1nc(C(=O)Nc2ccc3nc([nH]c3c2)-c2ccc(cc2)C2CCC(CC(O)=O)CC2)c(o1)C(F)(F)F \|(27.76,-35.76,;29.29,-35.6,;30.33,-36.73,;31.72,-36.1,;33.06,-36.86,;33.07,-38.4,;34.39,-36.09,;35.73,-36.85,;35.73,-38.39,;37.06,-39.15,;38.4,-38.37,;39.87,-38.83,;40.76,-37.57,;39.84,-36.34,;38.38,-36.83,;37.05,-36.07,;42.29,-37.56,;43.08,-38.88,;44.62,-38.87,;45.37,-37.52,;44.58,-36.19,;43.04,-36.22,;46.91,-37.5,;47.69,-38.83,;49.23,-38.81,;49.99,-37.47,;51.53,-37.46,;52.29,-36.12,;53.83,-36.11,;51.5,-34.79,;49.2,-36.15,;47.66,-36.16,;31.56,-34.57,;30.05,-34.26,;32.7,-33.54,;34.17,-34.01,;32.38,-32.03,;33.78,-32.44,)\|
BDBM50437744	Cc1oc(nc1C(=O)Nc1ccc2nc([nH]c2c1)-c1ccc(cc1)C1CCC(CC(O)=O)CC1)-c1ccccc1 \|(2.06,-32.51,;.92,-33.54,;-.59,-33.23,;-1.37,-34.57,;-.32,-35.71,;1.08,-35.07,;2.42,-35.83,;2.43,-37.37,;3.75,-35.06,;5.09,-35.82,;5.09,-37.36,;6.42,-38.13,;7.76,-37.34,;9.23,-37.81,;10.12,-36.55,;9.21,-35.32,;7.74,-35.8,;6.41,-35.05,;11.66,-36.53,;12.44,-37.86,;13.98,-37.84,;14.73,-36.5,;13.94,-35.17,;12.41,-35.19,;16.27,-36.47,;17.05,-37.8,;18.59,-37.79,;19.35,-36.45,;20.89,-36.43,;21.65,-35.09,;23.19,-35.08,;20.87,-33.77,;18.56,-35.12,;17.02,-35.13,;-2.89,-34.74,;-3.8,-33.49,;-5.33,-33.66,;-5.94,-35.08,;-5.03,-36.32,;-3.51,-36.14,)\|
BDBM50437745	OC(=O)CC1CCC(CC1)c1ccc(cc1)-c1nc2ccc(NC(=O)c3cc4ccccc4o3)cc2[nH]1 \|(81.34,-20.1,;79.8,-20.11,;79.02,-18.78,;79.04,-21.45,;77.5,-21.46,;76.74,-22.8,;75.2,-22.82,;74.42,-21.49,;75.17,-20.15,;76.71,-20.13,;72.88,-21.51,;72.12,-22.86,;70.58,-22.87,;69.8,-21.54,;70.55,-20.21,;72.09,-20.18,;68.26,-21.56,;67.37,-22.82,;65.9,-22.36,;64.57,-23.14,;63.23,-22.38,;63.23,-20.84,;61.89,-20.07,;60.56,-20.85,;60.57,-22.39,;59.22,-20.08,;57.82,-20.72,;56.78,-19.58,;55.25,-19.59,;54.48,-18.27,;55.24,-16.92,;56.78,-16.92,;57.55,-18.25,;59.06,-18.56,;64.55,-20.06,;65.89,-20.82,;67.35,-20.33,)\|
BDBM50437746	OC(=O)CC1CCC(CC1)c1ccc(cc1)-c1nc2ccc(NC(=O)c3cc4ccccc4s3)cc2[nH]1 \|(52.19,-18.93,;50.65,-18.94,;49.87,-17.61,;49.89,-20.28,;48.35,-20.29,;47.59,-21.63,;46.06,-21.65,;45.27,-20.32,;46.02,-18.98,;47.57,-18.97,;43.74,-20.34,;42.98,-21.69,;41.44,-21.7,;40.66,-20.38,;41.41,-19.04,;42.95,-19.01,;39.12,-20.4,;38.23,-21.65,;36.76,-21.19,;35.42,-21.97,;34.09,-21.21,;34.09,-19.67,;32.75,-18.9,;31.42,-19.68,;31.42,-21.22,;30.08,-18.91,;28.68,-19.55,;27.64,-18.41,;26.11,-18.42,;25.33,-17.1,;26.1,-15.75,;27.64,-15.75,;28.41,-17.08,;29.92,-17.39,;35.41,-18.89,;36.75,-19.65,;38.21,-19.16,)\|
BDBM50437747	OC(=O)CC1CCC(CC1)c1ccc(cc1)-c1nc2ccc(NC(=O)c3ccco3)cc2[nH]1 \|(81.89,-10.87,;80.35,-10.88,;79.57,-9.55,;79.6,-12.22,;78.06,-12.23,;77.29,-13.57,;75.76,-13.59,;74.98,-12.26,;75.73,-10.92,;77.27,-10.9,;73.44,-12.28,;72.69,-13.63,;71.15,-13.64,;70.36,-12.31,;71.11,-10.98,;72.65,-10.95,;68.83,-12.33,;67.94,-13.59,;66.47,-13.13,;65.13,-13.91,;63.8,-13.15,;63.8,-11.61,;62.46,-10.84,;61.13,-11.62,;61.13,-13.16,;59.79,-10.85,;58.4,-11.49,;57.36,-10.35,;58.12,-9.01,;59.63,-9.33,;65.12,-10.83,;66.45,-11.59,;67.91,-11.1,)\|
BDBM50437748	OC(=O)CC1CCC(CC1)c1ccc(cc1)-c1nc2ccc(NC(=O)c3cccs3)cc2[nH]1 \|(54.44,-11.16,;52.9,-11.18,;52.12,-9.85,;52.14,-12.52,;50.6,-12.53,;49.84,-13.87,;48.3,-13.88,;47.52,-12.56,;48.27,-11.21,;49.81,-11.2,;45.99,-12.58,;45.23,-13.92,;43.69,-13.94,;42.91,-12.61,;43.66,-11.27,;45.19,-11.25,;41.37,-12.63,;40.48,-13.89,;39.01,-13.42,;37.67,-14.21,;36.34,-13.44,;36.34,-11.9,;35,-11.14,;33.67,-11.91,;33.68,-13.45,;32.34,-11.15,;30.94,-11.79,;29.9,-10.65,;30.66,-9.31,;32.17,-9.63,;37.66,-11.13,;39,-11.88,;40.46,-11.4,)\|
BDBM50437749	OC(=O)CC1CCC(CC1)c1ccc(cc1)-c1nc2ccc(NC(=O)c3ccccc3)cc2[nH]1 \|(26.59,-10.6,;25.05,-10.61,;24.27,-9.28,;24.29,-11.95,;22.75,-11.96,;21.99,-13.3,;20.46,-13.32,;19.68,-11.99,;20.43,-10.65,;21.97,-10.63,;18.14,-12.01,;17.38,-13.36,;15.85,-13.37,;15.06,-12.04,;15.81,-10.7,;17.35,-10.68,;13.53,-12.06,;12.63,-13.32,;11.16,-12.86,;9.83,-13.64,;8.49,-12.88,;8.49,-11.34,;7.16,-10.57,;5.83,-11.35,;5.83,-12.89,;4.49,-10.58,;4.49,-9.04,;3.16,-8.28,;1.82,-9.05,;1.84,-10.6,;3.17,-11.36,;9.82,-10.56,;11.15,-11.32,;12.61,-10.83,)\|
BDBM50437750	OC(=O)CC1CCC(CC1)c1ccc(cc1)-c1nc2ccc(NC(=S)Nc3ccccc3)cc2[nH]1 \|(80.86,-2.17,;79.32,-2.18,;78.54,-.86,;78.56,-3.52,;77.02,-3.54,;76.26,-4.88,;74.73,-4.89,;73.94,-3.56,;74.69,-2.22,;76.24,-2.21,;72.41,-3.59,;71.65,-4.93,;70.11,-4.95,;69.33,-3.62,;70.08,-2.28,;71.62,-2.26,;67.79,-3.64,;66.9,-4.89,;65.43,-4.43,;64.1,-5.22,;62.76,-4.45,;62.76,-2.91,;61.43,-2.15,;60.1,-2.92,;60.1,-4.46,;58.76,-2.16,;57.43,-2.93,;56.09,-2.17,;54.76,-2.94,;54.76,-4.48,;56.1,-5.26,;57.43,-4.48,;64.08,-2.13,;65.42,-2.89,;66.88,-2.41,)\|
BDBM50437751	NC(=S)Nc1ccc2nc([nH]c2c1)-c1ccc(cc1)C1CCC(CC(O)=O)CC1 \|(30.43,-2.9,;31.76,-3.67,;31.77,-5.21,;33.1,-2.89,;34.43,-3.66,;34.43,-5.2,;35.77,-5.96,;37.1,-5.18,;38.57,-5.64,;39.46,-4.38,;38.55,-3.15,;37.09,-3.64,;35.75,-2.88,;41,-4.36,;41.78,-5.69,;43.32,-5.68,;44.08,-4.33,;43.28,-3,;41.75,-3.03,;45.61,-4.31,;46.4,-5.64,;47.93,-5.62,;48.69,-4.28,;50.23,-4.27,;50.99,-2.93,;52.53,-2.92,;50.21,-1.6,;47.91,-2.96,;46.36,-2.97,)\|
BDBM50437752	OC(=O)CC1CCC(CC1)c1ccc(cc1)-c1nc2ccc(NC(=O)Nc3ccccc3)cc2[nH]1 \|(27.27,-2.57,;25.73,-2.58,;24.95,-1.25,;24.97,-3.92,;23.43,-3.93,;22.67,-5.27,;21.13,-5.29,;20.35,-3.96,;21.1,-2.62,;22.65,-2.61,;18.82,-3.98,;18.06,-5.33,;16.52,-5.34,;15.74,-4.01,;16.49,-2.68,;18.02,-2.65,;14.2,-4.03,;13.31,-5.29,;11.84,-4.83,;10.51,-5.61,;9.17,-4.85,;9.17,-3.31,;7.83,-2.54,;6.5,-3.32,;6.51,-4.86,;5.17,-2.55,;3.84,-3.33,;2.5,-2.57,;1.17,-3.34,;1.17,-4.88,;2.5,-5.65,;3.84,-4.88,;10.49,-2.53,;11.83,-3.29,;13.29,-2.8,)\|
BDBM50437753	OC(=O)CC1CCC(CC1)c1ccc(cc1)-c1nc2ccc(NC(=O)c3nc(oc3C(F)(F)F)-c3ccccc3)cc2[nH]1 \|(55.73,-27.91,;54.2,-27.92,;53.41,-26.59,;53.44,-29.26,;51.9,-29.27,;51.14,-30.61,;49.6,-30.63,;48.82,-29.3,;49.57,-27.96,;51.11,-27.95,;47.28,-29.32,;46.53,-30.67,;44.99,-30.68,;44.2,-29.35,;44.95,-28.02,;46.49,-27.99,;42.67,-29.37,;41.78,-30.63,;40.31,-30.17,;38.97,-30.95,;37.64,-30.19,;37.64,-28.65,;36.3,-27.89,;34.97,-28.66,;34.98,-30.2,;33.63,-27.9,;32.24,-28.53,;31.2,-27.4,;31.96,-26.06,;33.47,-26.37,;34.61,-25.34,;36.08,-25.81,;34.29,-23.83,;35.93,-24.55,;29.67,-27.56,;28.76,-26.32,;27.23,-26.49,;26.61,-27.9,;27.53,-29.15,;29.06,-28.97,;38.96,-27.87,;40.29,-28.63,;41.76,-28.14,)\|
BDBM50437754	OC(=O)CC1CCC(CC1)c1ccc(cc1)-c1nc2ccc(NC(=O)c3nc(oc3C(F)(F)F)-c3ccccc3C(F)(F)F)cc2[nH]1 \|(28,-45.92,;26.46,-45.93,;25.68,-44.61,;25.7,-47.27,;24.16,-47.29,;23.4,-48.63,;21.87,-48.64,;21.08,-47.31,;21.83,-45.97,;23.38,-45.96,;19.55,-47.34,;18.79,-48.68,;17.25,-48.7,;16.47,-47.37,;17.22,-46.03,;18.75,-46.01,;14.93,-47.39,;14.04,-48.64,;12.57,-48.18,;11.24,-48.97,;9.9,-48.2,;9.9,-46.66,;8.57,-45.9,;7.23,-46.67,;7.24,-48.21,;5.9,-45.91,;4.5,-46.55,;3.46,-45.41,;4.22,-44.07,;5.73,-44.38,;6.88,-43.35,;8.34,-43.82,;6.55,-41.84,;7.96,-42.25,;1.93,-45.58,;1.03,-44.34,;-.5,-44.51,;-1.13,-45.92,;-.21,-47.16,;1.33,-46.98,;2.24,-48.22,;1.63,-49.63,;3.77,-48.04,;3,-49.54,;11.22,-45.88,;12.56,-46.64,;14.02,-46.16,)\|
BDBM50436840	CC(C)[C@H](NC(=O)c1ncc(s1)-c1ccc(NC(=O)C2CCC(F)(F)CC2)cc1)C(O)=O \|r\|
BDBM50436841	CC(C)[C@H](NC(=O)c1ncc(s1)-c1ccc(NC(=O)CCC2CCCCC2)cc1)C(O)=O \|r\|
BDBM50436842	CC(C)[C@H](NC(=O)c1ncc(s1)-c1ccc(NC(=O)c2ccc(cc2)C(C)(C)C)cc1)C(O)=O \|r\|
BDBM50436843	CC(C)[C@H](NC(=O)c1ncc(s1)-c1ccc(NC(=O)Nc2ccc(Cl)cc2Oc2ccccc2)cc1)C(O)=O \|r\|
BDBM50436844	CC(C)[C@H](NC(=O)c1ncc(s1)-c1ccc(NC(=O)Nc2ccccc2Oc2ccccc2)cc1)C(O)=O \|r\|
BDBM50436845	CC(C)[C@H](NC(=O)c1ncc(s1)-c1ccc(NC(=O)Nc2ccc(C)c(C)c2)cc1)C(O)=O \|r\|
BDBM50436846	CC(C)[C@H](NC(=O)c1ncc(s1)-c1ccc(NC(=O)Nc2ccccc2Cl)cc1)C(O)=O \|r\|
BDBM50436847	CC(C)[C@H](NC(=O)c1ncc(s1)-c1ccc(NC(=O)Nc2cccc(c2)C(F)(F)F)cc1)C(O)=O \|r\|
BDBM50436848	CC(C)[C@H](NC(=O)c1ncc(s1)-c1ccc(Nc2nc3ccc(F)cc3s2)cc1)C(O)=O \|r\|
BDBM50437373	OC(=O)[C@H]1CC[C@@H](CC1)Oc1ccc(cn1)-c1ccc(cn1)-c1nc2ccc(F)cc2[nH]1 \|r,wU:6.9,wD:3.2,(41.17,-15.73,;41.94,-14.39,;43.48,-14.4,;41.17,-13.05,;41.94,-11.72,;41.17,-10.38,;39.63,-10.4,;38.86,-11.72,;39.63,-13.05,;38.86,-9.07,;37.32,-9.07,;36.54,-7.73,;35.01,-7.74,;34.24,-9.07,;35.01,-10.41,;36.55,-10.41,;32.71,-9.07,;31.93,-7.73,;30.39,-7.74,;29.63,-9.07,;30.4,-10.41,;31.94,-10.41,;28.09,-9.07,;27.19,-10.32,;25.72,-9.84,;24.39,-10.6,;23.06,-9.84,;23.06,-8.3,;21.72,-7.53,;24.39,-7.52,;25.72,-8.3,;27.19,-7.82,)\|
BDBM50437374	OC(=O)[C@@H]1CC[C@@H](CC1)Oc1ccc(cn1)-c1ccc(cn1)-c1nc2ccc(F)cc2[nH]1 \|r,wU:6.9,3.2,(20.33,-15.61,;21.11,-14.28,;22.65,-14.28,;20.33,-12.94,;21.1,-11.6,;20.33,-10.26,;18.8,-10.28,;18.03,-11.61,;18.79,-12.93,;18.03,-8.95,;16.49,-8.95,;15.71,-7.62,;14.17,-7.63,;13.41,-8.96,;14.18,-10.29,;15.72,-10.29,;11.87,-8.96,;11.09,-7.62,;9.56,-7.62,;8.79,-8.95,;9.56,-10.29,;11.1,-10.29,;7.26,-8.95,;6.35,-10.2,;4.88,-9.72,;3.55,-10.48,;2.22,-9.72,;2.22,-8.18,;.89,-7.42,;3.55,-7.4,;4.88,-8.18,;6.35,-7.71,)\|
BDBM50437375	OC(=O)[C@H]1CC[C@@H](CC1)Oc1ccc(cn1)-c1ccc(cn1)-c1nc2ccccc2[nH]1 \|r,wU:6.9,wD:3.2,(39.03,-7.93,;39.8,-6.59,;41.34,-6.6,;39.02,-5.25,;39.79,-3.92,;39.02,-2.58,;37.49,-2.6,;36.72,-3.92,;37.48,-5.25,;36.72,-1.27,;35.18,-1.27,;34.4,.07,;32.86,.06,;32.1,-1.27,;32.87,-2.61,;34.41,-2.61,;30.56,-1.27,;29.79,.07,;28.25,.06,;27.48,-1.27,;28.25,-2.61,;29.79,-2.61,;25.95,-1.27,;25.04,-.02,;23.57,-.5,;22.24,.28,;20.91,-.5,;20.91,-2.04,;22.24,-2.8,;23.57,-2.04,;25.04,-2.52,)\|
BDBM50437376	OC(=O)[C@@H]1CC[C@@H](CC1)Oc1ccc(cn1)-c1ccc(cn1)-c1nc2ccccc2[nH]1 \|r,wU:6.9,3.2,(18.34,-7.94,;19.12,-6.61,;20.66,-6.61,;18.34,-5.27,;19.11,-3.93,;18.34,-2.59,;16.81,-2.61,;16.03,-3.94,;16.8,-5.26,;16.03,-1.28,;14.49,-1.29,;13.71,.06,;12.18,.05,;11.42,-1.29,;12.19,-2.62,;13.72,-2.62,;9.88,-1.29,;9.1,.06,;7.57,.05,;6.8,-1.28,;7.57,-2.62,;9.11,-2.62,;5.26,-1.28,;4.36,-.04,;2.89,-.51,;1.56,.26,;.23,-.51,;.23,-2.05,;1.56,-2.82,;2.89,-2.06,;4.36,-2.53,)\|
BDBM50437377	COc1ccc2[nH]c(nc2n1)-c1ccc(nc1)-c1ccc(O[C@H]2CC[C@@H](CC2)C(O)=O)nc1 \|r,wU:22.24,wD:25.31,(24.23,-45.19,;24.23,-46.73,;25.57,-47.5,;25.57,-49.04,;26.89,-49.8,;28.22,-49.04,;29.69,-49.52,;30.6,-48.27,;29.69,-47.02,;28.22,-47.5,;26.89,-46.72,;32.14,-48.27,;32.9,-46.94,;34.44,-46.93,;35.21,-48.27,;34.44,-49.61,;32.9,-49.61,;36.75,-48.27,;37.51,-46.94,;39.05,-46.93,;39.83,-48.27,;41.37,-48.27,;42.14,-49.6,;43.67,-49.58,;44.44,-50.92,;43.67,-52.25,;42.13,-52.25,;41.37,-50.92,;44.45,-53.6,;43.68,-54.93,;45.99,-53.6,;39.06,-49.61,;37.52,-49.61,)\|
BDBM50437378	COc1ccc2[nH]c(nc2n1)-c1ccc(nc1)-c1ccc(O[C@H]2CC[C@H](CC2)C(O)=O)nc1 \|r,wU:22.24,25.31,(.58,-45.14,;.59,-46.68,;1.92,-47.44,;1.92,-48.99,;3.25,-49.75,;4.58,-48.99,;6.05,-49.46,;6.95,-48.22,;6.05,-46.97,;4.58,-47.44,;3.25,-46.67,;8.49,-48.22,;9.26,-46.89,;10.79,-46.88,;11.57,-48.22,;10.8,-49.55,;9.26,-49.55,;13.1,-48.22,;13.87,-46.89,;15.4,-46.88,;16.18,-48.22,;17.72,-48.21,;18.5,-49.54,;20.03,-49.53,;20.8,-50.86,;20.03,-52.2,;18.49,-52.2,;17.72,-50.87,;20.8,-53.54,;20.03,-54.87,;22.34,-53.54,;15.41,-49.55,;13.87,-49.55,)\|
BDBM50437379	Cc1ccc2[nH]c(nc2n1)-c1ccc(nc1)-c1ccc(O[C@H]2CC[C@@H](CC2)C(O)=O)nc1 \|r,wU:21.23,wD:24.30,(23.65,-38.67,;24.99,-39.43,;24.99,-40.97,;26.32,-41.74,;27.65,-40.98,;29.12,-41.45,;30.02,-40.21,;29.12,-38.96,;27.65,-39.43,;26.32,-38.66,;31.56,-40.2,;32.32,-38.88,;33.86,-38.87,;34.64,-40.21,;33.87,-41.54,;32.33,-41.54,;36.17,-40.21,;36.94,-38.88,;38.47,-38.87,;39.25,-40.21,;40.79,-40.2,;41.57,-41.53,;43.1,-41.51,;43.87,-42.85,;43.1,-44.19,;41.56,-44.19,;40.79,-42.86,;43.87,-45.53,;43.1,-46.86,;45.41,-45.53,;38.48,-41.54,;36.94,-41.54,)\|
BDBM50437380	Cc1ccc2[nH]c(nc2n1)-c1ccc(nc1)-c1ccc(O[C@H]2CC[C@H](CC2)C(O)=O)nc1 \|r,wU:21.23,24.30,(.81,-39.8,;2.15,-40.56,;2.15,-42.1,;3.48,-42.86,;4.8,-42.1,;6.27,-42.58,;7.18,-41.33,;6.27,-40.09,;4.8,-40.56,;3.48,-39.78,;8.72,-41.33,;9.48,-40,;11.02,-40,;11.79,-41.34,;11.02,-42.67,;9.48,-42.67,;13.33,-41.34,;14.09,-40,;15.63,-40,;16.41,-41.33,;17.95,-41.33,;18.72,-42.66,;20.26,-42.64,;21.03,-43.98,;20.26,-45.32,;18.71,-45.31,;17.95,-43.99,;21.03,-46.66,;20.26,-47.99,;22.57,-46.66,;15.64,-42.67,;14.1,-42.67,)\|
BDBM50437381	CS(=O)(=O)c1ccc2nc([nH]c2c1)-c1ccc(nc1)-c1ccc(O[C@H]2CC[C@@H](CC2)C(O)=O)nc1 \|r,wU:24.26,wD:27.33,(48.42,-30.59,;48.42,-32.13,;47.64,-33.46,;46.88,-32.12,;49.76,-32.9,;49.76,-34.44,;51.08,-35.2,;52.41,-34.44,;53.88,-34.92,;54.79,-33.67,;53.88,-32.42,;52.41,-32.9,;51.08,-32.12,;56.32,-33.67,;57.09,-32.34,;58.63,-32.34,;59.4,-33.67,;58.63,-35.01,;57.09,-35.01,;60.94,-33.67,;61.7,-32.34,;63.24,-32.34,;64.02,-33.67,;65.56,-33.67,;66.33,-35,;67.86,-34.98,;68.63,-36.32,;67.86,-37.66,;66.32,-37.65,;65.56,-36.32,;68.64,-39,;67.87,-40.33,;70.18,-39,;63.25,-35.01,;61.71,-35.01,)\|
BDBM50437382	CS(=O)(=O)c1ccc2nc([nH]c2c1)-c1ccc(nc1)-c1ccc(O[C@H]2CC[C@H](CC2)C(O)=O)nc1 \|r,wU:24.26,27.33,(23.63,-29.94,;23.63,-31.48,;22.85,-32.81,;22.09,-31.47,;24.97,-32.25,;24.97,-33.79,;26.3,-34.55,;27.63,-33.79,;29.09,-34.27,;30,-33.02,;29.09,-31.77,;27.63,-32.25,;26.3,-31.47,;31.54,-33.02,;32.3,-31.69,;33.84,-31.68,;34.62,-33.02,;33.84,-34.36,;32.31,-34.36,;36.15,-33.02,;36.91,-31.69,;38.45,-31.68,;39.23,-33.02,;40.77,-33.02,;41.54,-34.35,;43.08,-34.33,;43.85,-35.67,;43.08,-37,;41.54,-37,;40.77,-35.67,;43.85,-38.34,;43.08,-39.68,;45.39,-38.35,;38.46,-34.36,;36.92,-34.36,)\|
BDBM50437383	OC(=O)[C@@H]1CC[C@@H](CC1)Oc1ccc(cn1)-c1ccc(cn1)-c1nc2ccc(OC(F)(F)F)cc2[nH]1 \|r,wU:6.9,3.2,(19.56,-40.23,;20.34,-38.9,;21.88,-38.9,;19.56,-37.56,;20.33,-36.23,;19.56,-34.89,;18.03,-34.91,;17.25,-36.23,;18.02,-37.56,;17.26,-33.57,;15.72,-33.58,;14.94,-32.24,;13.4,-32.25,;12.64,-33.58,;13.41,-34.92,;14.95,-34.91,;11.1,-33.58,;10.32,-32.24,;8.79,-32.25,;8.02,-33.58,;8.79,-34.91,;10.33,-34.91,;6.49,-33.58,;5.58,-34.82,;4.11,-34.35,;2.78,-35.11,;1.45,-34.35,;1.45,-32.81,;.12,-32.04,;.11,-30.5,;-1.22,-29.73,;1.45,-29.73,;.1,-28.96,;2.78,-32.03,;4.11,-32.81,;5.58,-32.33,)\|
BDBM50437384	OC(=O)[C@H]1CC[C@@H](CC1)Oc1ccc(cn1)-c1ccc(cn1)-c1nc2ccc(cc2[nH]1)C#N \|r,wU:6.9,wD:3.2,(44.1,-31.71,;44.87,-30.37,;46.41,-30.37,;44.1,-29.03,;44.87,-27.7,;44.1,-26.36,;42.56,-26.38,;41.79,-27.7,;42.56,-29.03,;41.79,-25.04,;40.25,-25.05,;39.47,-23.71,;37.93,-23.72,;37.17,-25.05,;37.94,-26.39,;39.48,-26.38,;35.64,-25.05,;34.86,-23.71,;33.32,-23.72,;32.56,-25.05,;33.33,-26.38,;34.86,-26.38,;31.02,-25.05,;30.11,-26.29,;28.65,-25.82,;27.32,-26.58,;25.99,-25.82,;25.99,-24.28,;27.32,-23.5,;28.65,-24.28,;30.11,-23.8,;24.65,-23.51,;23.32,-22.75,)\|
BDBM50437385	OC(=O)[C@@H]1CC[C@@H](CC1)Oc1ccc(cn1)-c1ccc(cn1)-c1nc2ccc(cc2[nH]1)C#N \|r,wU:6.9,3.2,(19.65,-30.15,;20.42,-28.82,;21.96,-28.82,;19.65,-27.48,;20.42,-26.15,;19.65,-24.81,;18.11,-24.83,;17.34,-26.15,;18.11,-27.48,;17.34,-23.49,;15.8,-23.5,;15.02,-22.16,;13.48,-22.17,;12.72,-23.5,;13.49,-24.83,;15.03,-24.83,;11.19,-23.5,;10.41,-22.16,;8.87,-22.17,;8.11,-23.5,;8.88,-24.83,;10.42,-24.83,;6.57,-23.5,;5.66,-24.74,;4.2,-24.27,;2.87,-25.03,;1.54,-24.27,;1.54,-22.73,;2.87,-21.95,;4.2,-22.73,;5.66,-22.25,;.2,-21.96,;-1.14,-21.19,)\|
BDBM50437386	OC(=O)[C@H]1CC[C@@H](CC1)Oc1ccc(cn1)-c1ccc(cn1)-c1nc2cc(F)c(F)cc2[nH]1 \|r,wU:6.9,wD:3.2,(42.85,-23.43,;43.62,-22.1,;45.16,-22.1,;42.85,-20.75,;43.62,-19.42,;42.85,-18.08,;41.32,-18.1,;40.54,-19.42,;41.31,-20.75,;40.54,-16.77,;39,-16.77,;38.22,-15.43,;36.69,-15.44,;35.92,-16.77,;36.69,-18.11,;38.23,-18.11,;34.39,-16.77,;33.61,-15.43,;32.08,-15.44,;31.31,-16.77,;32.08,-18.11,;33.62,-18.11,;29.77,-16.77,;28.87,-15.52,;27.4,-16,;26.07,-15.22,;24.74,-16,;23.41,-15.23,;24.74,-17.54,;23.41,-18.31,;26.07,-18.3,;27.4,-17.54,;28.87,-18.02,)\|
BDBM50437387	OC(=O)[C@@H]1CC[C@@H](CC1)Oc1ccc(cn1)-c1ccc(cn1)-c1nc2cc(F)c(F)cc2[nH]1 \|r,wU:6.9,3.2,(20.49,-23.1,;21.26,-21.77,;22.8,-21.77,;20.49,-20.43,;21.26,-19.09,;20.49,-17.75,;18.95,-17.77,;18.18,-19.1,;18.95,-20.42,;18.18,-16.44,;16.64,-16.44,;15.86,-15.11,;14.32,-15.11,;13.56,-16.45,;14.33,-17.78,;15.87,-17.78,;12.03,-16.45,;11.25,-15.11,;9.71,-15.11,;8.95,-16.44,;9.72,-17.78,;11.26,-17.78,;7.41,-16.44,;6.5,-15.2,;5.04,-15.67,;3.71,-14.89,;2.38,-15.67,;1.04,-14.91,;2.38,-17.21,;1.05,-17.98,;3.71,-17.97,;5.04,-17.21,;6.5,-17.69,)\|
BDBM50437388	OC(=O)C[C@H]1CC[C@@H](CC1)c1ccc(cc1)-c1ccc(cn1)-c1nc2ccc(Cl)cc2[nH]1 \|r,wU:7.10,wD:4.3,(31.44,-46.33,;32.2,-44.99,;33.75,-45,;31.43,-43.66,;29.89,-43.65,;29.12,-42.32,;27.58,-42.32,;26.82,-43.65,;27.59,-44.99,;29.12,-44.99,;25.28,-43.66,;24.51,-45,;22.97,-45,;22.2,-43.66,;22.97,-42.33,;24.5,-42.32,;20.67,-43.66,;19.89,-42.32,;18.36,-42.33,;17.59,-43.66,;18.36,-44.99,;19.9,-45,;16.05,-43.66,;15.15,-44.91,;13.68,-44.43,;12.35,-45.19,;11.02,-44.43,;11.02,-42.89,;9.69,-42.12,;12.35,-42.11,;13.68,-42.89,;15.15,-42.41,)\|
BDBM50437389	OC(=O)C[C@H]1CC[C@@H](CC1)c1ccc(cc1)-c1ccc(cn1)-c1nc2ccc(cc2[nH]1)C(F)(F)F \|r,wU:7.10,wD:4.3,(30.36,-37.13,;31.13,-35.8,;32.67,-35.8,;30.36,-34.46,;28.82,-34.46,;28.05,-33.12,;26.5,-33.12,;25.74,-34.46,;26.51,-35.79,;28.05,-35.79,;24.21,-34.46,;23.44,-35.8,;21.9,-35.8,;21.13,-34.47,;21.89,-33.14,;23.43,-33.13,;19.6,-34.47,;18.82,-33.13,;17.28,-33.13,;16.52,-34.46,;17.29,-35.8,;18.82,-35.8,;14.98,-34.46,;14.07,-35.71,;12.61,-35.23,;11.28,-35.99,;9.95,-35.23,;9.95,-33.69,;11.28,-32.91,;12.61,-33.69,;14.07,-33.22,;8.61,-32.93,;8.61,-31.39,;7.28,-33.7,;7.27,-32.15,)\|
BDBM50437390	OC(=O)[C@H]1CC[C@@H](CC1)Oc1ccc(cn1)-c1ccc(cn1)-c1nc2ccc(Cl)cc2[nH]1 \|r,wU:6.9,wD:3.2,(43.88,-64.06,;44.65,-62.73,;46.19,-62.73,;43.87,-61.38,;44.64,-60.05,;43.87,-58.71,;42.34,-58.73,;41.57,-60.05,;42.33,-61.38,;41.57,-57.4,;40.03,-57.4,;39.25,-56.06,;37.71,-56.07,;36.95,-57.4,;37.72,-58.74,;39.26,-58.74,;35.41,-57.4,;34.63,-56.06,;33.1,-56.07,;32.33,-57.4,;33.1,-58.74,;34.64,-58.74,;30.79,-57.4,;29.89,-58.65,;28.42,-58.17,;27.09,-58.93,;25.76,-58.17,;25.76,-56.63,;24.43,-55.86,;27.09,-55.85,;28.42,-56.63,;29.89,-56.15,)\|
BDBM50437391	OC(=O)[C@@H]1CC[C@@H](CC1)Oc1ccc(cn1)-c1ccc(cn1)-c1nc2ccc(Cl)cc2[nH]1 \|r,wU:6.9,3.2,(43.88,-64.06,;44.65,-62.73,;46.19,-62.73,;43.87,-61.38,;44.64,-60.05,;43.87,-58.71,;42.34,-58.73,;41.57,-60.05,;42.33,-61.38,;41.57,-57.4,;40.03,-57.4,;39.25,-56.06,;37.71,-56.07,;36.95,-57.4,;37.72,-58.74,;39.26,-58.74,;35.41,-57.4,;34.63,-56.06,;33.1,-56.07,;32.33,-57.4,;33.1,-58.74,;34.64,-58.74,;30.79,-57.4,;29.89,-58.65,;28.42,-58.17,;27.09,-58.93,;25.76,-58.17,;25.76,-56.63,;24.43,-55.86,;27.09,-55.85,;28.42,-56.63,;29.89,-56.15,)\|
BDBM50437392	OC(=O)[C@H]1CC[C@@H](CC1)Oc1ccc(cn1)-c1ccc(cn1)-c1nc2ccc(cc2[nH]1)C(F)(F)F \|r,wU:6.9,wD:3.2,(20.2,-61.8,;20.97,-60.46,;22.51,-60.47,;20.2,-59.12,;20.97,-57.79,;20.2,-56.45,;18.67,-56.47,;17.89,-57.79,;18.66,-59.12,;17.89,-55.14,;16.35,-55.14,;15.57,-53.8,;14.04,-53.81,;13.27,-55.14,;14.04,-56.48,;15.58,-56.48,;11.74,-55.14,;10.96,-53.8,;9.43,-53.81,;8.66,-55.14,;9.43,-56.48,;10.97,-56.48,;7.12,-55.14,;6.22,-56.39,;4.75,-55.91,;3.42,-56.67,;2.09,-55.91,;2.09,-54.37,;3.42,-53.59,;4.75,-54.37,;6.22,-53.89,;.76,-53.6,;-.58,-54.38,;.75,-52.06,;-.58,-52.83,)\|
BDBM50437393	OC(=O)[C@@H]1CC[C@@H](CC1)Oc1ccc(cn1)-c1ccc(cn1)-c1nc2ccc(cc2[nH]1)C(F)(F)F \|r,wU:6.9,3.2,(20.2,-61.8,;20.97,-60.46,;22.51,-60.47,;20.2,-59.12,;20.97,-57.79,;20.2,-56.45,;18.67,-56.47,;17.89,-57.79,;18.66,-59.12,;17.89,-55.14,;16.35,-55.14,;15.57,-53.8,;14.04,-53.81,;13.27,-55.14,;14.04,-56.48,;15.58,-56.48,;11.74,-55.14,;10.96,-53.8,;9.43,-53.81,;8.66,-55.14,;9.43,-56.48,;10.97,-56.48,;7.12,-55.14,;6.22,-56.39,;4.75,-55.91,;3.42,-56.67,;2.09,-55.91,;2.09,-54.37,;3.42,-53.59,;4.75,-54.37,;6.22,-53.89,;.76,-53.6,;-.58,-54.38,;.75,-52.06,;-.58,-52.83,)\|
BDBM50438732	COC1CCN(CC1)C(=O)C[C@H]1CC[C@@H](CC1)c1ccc(cc1)N1CCOc2ncnc(N)c2C1=O \|r,wU:14.18,wD:11.11,(50.69,-40.93,;49.17,-40.68,;48.17,-41.89,;46.66,-41.63,;45.68,-42.82,;46.22,-44.29,;47.73,-44.51,;48.71,-43.33,;45.22,-45.51,;45.76,-46.95,;43.71,-45.25,;42.71,-46.47,;41.19,-46.22,;40.21,-47.4,;40.76,-48.87,;42.26,-49.09,;43.23,-47.91,;39.75,-50.09,;38.24,-49.84,;37.25,-51.03,;37.8,-52.48,;39.31,-52.71,;40.29,-51.53,;36.8,-53.69,;37.47,-55.1,;36.78,-56.5,;35.26,-56.83,;34.06,-55.83,;32.7,-56.61,;31.36,-55.82,;31.37,-54.26,;32.73,-53.49,;32.75,-51.94,;34.07,-54.29,;35.3,-53.33,;34.97,-51.8,)\|
BDBM50438733	Nc1ncnc2OCCN(c3ccc(cc3)[C@H]3CC[C@H](CC#N)CC3)C(=O)c12 \|r,wU:16.16,wD:19.20,(28.43,-50.53,;28.37,-52.07,;27.01,-52.81,;26.96,-54.35,;28.27,-55.17,;29.63,-54.44,;30.8,-55.45,;32.31,-55.15,;33.03,-53.79,;32.4,-52.36,;33.42,-51.18,;34.91,-51.47,;35.91,-50.32,;35.41,-48.84,;33.93,-48.59,;32.93,-49.74,;36.43,-47.66,;35.94,-46.22,;36.94,-45.07,;38.43,-45.32,;39.44,-44.16,;40.96,-44.45,;42.47,-44.74,;38.94,-46.8,;37.93,-47.95,;30.93,-51.98,;30.63,-50.46,;29.68,-52.89,)\|
BDBM50438734	Nc1ncnc2OCCN(c3ccc(cc3)[C@H]3CC[C@H](CC(=O)NC4CCCC4)CC3)C(=O)c12 \|r,wU:16.16,wD:19.20,(18.45,-49.67,;18.43,-51.23,;17.08,-51.99,;17.06,-53.55,;18.41,-54.34,;19.76,-53.56,;20.96,-54.56,;22.49,-54.23,;23.17,-52.83,;22.49,-51.41,;23.5,-50.2,;25.01,-50.45,;25.99,-49.27,;25.44,-47.79,;23.94,-47.58,;22.96,-48.76,;26.44,-46.58,;25.91,-45.15,;26.89,-43.96,;28.39,-44.18,;29.39,-42.99,;30.92,-43.25,;31.46,-44.69,;31.91,-42.04,;33.43,-42.3,;34.11,-43.68,;35.64,-43.46,;35.9,-41.94,;34.54,-41.22,;28.94,-45.65,;27.95,-46.84,;20.99,-51.06,;20.67,-49.54,;19.77,-52.02,)\|
BDBM50438735	Cc1noc(C[C@H]2CC[C@@H](CC2)c2ccc(cc2)N2CCOc3ncnc(N)c3C2=O)n1 \|r,wU:9.12,wD:6.5,(36.55,-43.27,;35.45,-42.18,;35.71,-40.66,;34.32,-39.96,;33.22,-41.07,;31.72,-40.82,;30.73,-42.03,;29.22,-41.78,;28.26,-42.96,;28.81,-44.42,;30.3,-44.64,;31.27,-43.46,;27.82,-45.63,;26.31,-45.38,;25.34,-46.57,;25.88,-48.02,;27.38,-48.24,;28.35,-47.06,;24.9,-49.22,;25.54,-50.6,;24.91,-52.01,;23.38,-52.34,;22.18,-51.36,;20.84,-52.13,;19.5,-51.35,;19.51,-49.8,;20.86,-49.04,;20.86,-47.5,;22.19,-49.82,;23.4,-48.87,;23.07,-47.35,;33.93,-42.42,)\|
BDBM50438736	Cc1nc(N)c2c(OCCN(c3ccc(cc3)[C@H]3CC[C@H](CC(O)=O)CC3)C2=O)n1 \|r,wU:17.17,wD:20.21,(19.91,-46.4,;21.27,-45.67,;21.32,-44.12,;22.68,-43.39,;22.73,-41.85,;23.99,-44.21,;23.95,-45.74,;25.12,-46.75,;26.64,-46.45,;27.35,-45.08,;26.71,-43.66,;27.73,-42.47,;29.23,-42.76,;30.23,-41.6,;29.71,-40.12,;28.22,-39.87,;27.23,-41.03,;30.73,-38.94,;30.23,-37.5,;31.23,-36.34,;32.72,-36.6,;33.73,-35.42,;35.24,-35.71,;35.75,-37.16,;36.26,-34.54,;33.23,-38.06,;32.23,-39.22,;25.23,-43.28,;24.94,-41.76,;22.58,-46.48,)\|
BDBM50438737	CC(C)(O)C[C@H]1CC[C@@H](CC1)c1ccc(cc1)N1CCOc2ncnc(N)c2C1=O \|r,wU:8.11,wD:5.4,(35.63,-43.7,;35.14,-42.24,;36.17,-41.09,;36.63,-42.63,;33.64,-41.93,;32.61,-43.1,;31.12,-42.8,;30.1,-43.94,;30.6,-45.42,;32.08,-45.69,;33.1,-44.55,;29.56,-46.59,;28.07,-46.29,;27.05,-47.44,;27.54,-48.91,;29.04,-49.19,;30.05,-48.04,;26.52,-50.06,;27.13,-51.49,;26.4,-52.84,;24.87,-53.12,;23.72,-52.1,;22.34,-52.82,;21.04,-51.99,;21.11,-50.45,;22.47,-49.73,;22.54,-48.19,;23.78,-50.56,;25.03,-49.66,;24.75,-48.13,)\|
BDBM50438738	CN(C)c1ncnc2OCCN(c3ccc(cc3)[C@H]3CC[C@H](CC(O)=O)CC3)C(=O)c12 \|r,wU:18.18,wD:21.22,(19.7,-48.64,;21.01,-49.46,;22.39,-48.73,;20.96,-51.01,;19.6,-51.74,;19.55,-53.29,;20.86,-54.1,;22.23,-53.37,;23.41,-54.38,;24.94,-54.09,;25.65,-52.71,;25.01,-51.28,;26.03,-50.09,;27.53,-50.38,;28.53,-49.22,;28.02,-47.74,;26.53,-47.49,;25.53,-48.65,;29.05,-46.56,;28.55,-45.11,;29.55,-43.95,;31.04,-44.21,;32.06,-43.03,;33.58,-43.33,;34.6,-42.15,;34.08,-44.78,;31.55,-45.68,;30.55,-46.84,;23.52,-50.9,;23.23,-49.38,;22.28,-51.83,)\|
BDBM50438739	CNc1ncnc2OCCN(c3ccc(cc3)[C@H]3CC[C@H](CC(O)=O)CC3)C(=O)c12 \|r,wU:17.17,wD:20.21,(32.94,-48.64,;34.26,-49.45,;34.21,-51.01,;32.85,-51.74,;32.8,-53.28,;34.12,-54.1,;35.49,-53.36,;36.67,-54.37,;38.19,-54.06,;38.9,-52.69,;38.26,-51.26,;39.28,-50.07,;40.78,-50.36,;41.77,-49.2,;41.26,-47.71,;39.76,-47.47,;38.77,-48.63,;42.28,-46.53,;41.77,-45.08,;42.77,-43.92,;44.27,-44.17,;45.28,-43,;46.8,-43.29,;47.31,-44.74,;47.82,-42.1,;44.78,-45.65,;43.78,-46.81,;36.77,-50.89,;36.47,-49.37,;35.53,-51.82,)\|
BDBM50438740	COc1ncnc2OCCN(c3ccc(cc3)[C@H]3CC[C@H](CC(O)=O)CC3)C(=O)c12 \|r,wU:17.17,wD:20.21,(22.72,-46.81,;24.05,-47.6,;24.04,-49.14,;22.7,-49.91,;22.68,-51.45,;24.01,-52.24,;25.37,-51.47,;26.57,-52.46,;28.09,-52.12,;28.77,-50.73,;28.09,-49.31,;29.09,-48.11,;30.59,-48.36,;31.56,-47.18,;31.02,-45.7,;29.52,-45.49,;28.55,-46.67,;32.01,-44.5,;31.48,-43.06,;32.45,-41.88,;33.95,-42.1,;34.94,-40.9,;36.47,-41.16,;37.01,-42.6,;37.46,-39.96,;34.5,-43.56,;33.52,-44.75,;26.59,-48.97,;26.27,-47.46,;25.38,-49.93,)\|
BDBM50438741	OC(=O)C[C@H]1CC[C@@H](CC1)c1ccc(cc1)N1CCOc2nc[nH]c(=O)c2C1=O \|r,wU:7.10,wD:4.3,(30.06,-36.09,;29.05,-37.28,;29.57,-38.72,;27.53,-36.99,;26.52,-38.18,;25.03,-37.95,;24.04,-39.11,;24.56,-40.55,;26.06,-40.82,;27.05,-39.65,;23.54,-41.75,;24.07,-43.23,;23.08,-44.39,;21.58,-44.12,;21.06,-42.68,;22.05,-41.51,;20.57,-45.32,;21.22,-46.74,;20.52,-48.12,;19,-48.44,;17.82,-47.44,;16.46,-48.19,;15.13,-47.39,;15.16,-45.83,;16.52,-45.09,;16.56,-43.55,;17.85,-45.9,;19.08,-44.96,;18.77,-43.44,)\|
BDBM50438742	Nc1ncnc2OCC(=O)N(Cc12)c1ccc(cc1)[C@H]1CC[C@H](CC(O)=O)CC1 \|r,wU:19.21,wD:22.25,(28.52,-10.96,;28.5,-12.51,;27.15,-13.27,;27.13,-14.82,;28.47,-15.6,;29.82,-14.84,;31.01,-15.83,;32.53,-15.5,;33.22,-14.12,;34.76,-14.13,;32.55,-12.69,;31.06,-12.35,;29.83,-13.3,;33.55,-11.49,;35.05,-11.75,;36.03,-10.57,;35.49,-9.1,;34,-8.88,;33.02,-10.06,;36.49,-7.89,;35.96,-6.46,;36.94,-5.28,;38.44,-5.5,;39.43,-4.31,;40.95,-4.57,;41.95,-3.37,;41.5,-6.02,;38.98,-6.97,;38,-8.15,)\|
BDBM50438743	C[C@@H]1CN(c2ccc(cc2)[C@H]2CC[C@H](CC(O)=O)CC2)C(=O)c2c(N)ncnc2O1 \|r,wU:1.0,10.10,wD:13.14,(24.81,-45.4,;23.9,-44.15,;24.62,-42.79,;23.98,-41.35,;25.01,-40.18,;26.51,-40.48,;27.52,-39.33,;27.01,-37.84,;25.53,-37.59,;24.52,-38.74,;28.04,-36.67,;27.54,-35.23,;28.55,-34.08,;30.06,-34.35,;31.07,-33.19,;32.58,-33.49,;33.07,-34.94,;33.61,-32.31,;30.55,-35.81,;29.54,-36.97,;22.51,-40.98,;22.22,-39.45,;21.26,-41.89,;19.96,-41.07,;20.02,-39.52,;18.59,-41.78,;18.53,-43.33,;19.84,-44.15,;21.21,-43.43,;22.37,-44.44,)\|
BDBM50438744	NC(=O)C[C@H]1CC[C@@H](CC1)c1ccc(cc1)N1CCOc2ncnc(N)c2C1=O \|r,wU:7.10,wD:4.3,(38.2,-37.65,;37.22,-38.85,;37.76,-40.29,;35.69,-38.61,;34.72,-39.81,;33.22,-39.6,;32.26,-40.78,;32.8,-42.2,;34.3,-42.45,;35.27,-41.26,;31.81,-43.41,;32.37,-44.88,;31.41,-46.06,;29.91,-45.81,;29.36,-44.39,;30.32,-43.21,;28.92,-47.03,;29.6,-48.43,;28.93,-49.82,;27.42,-50.17,;26.22,-49.19,;24.88,-49.96,;23.54,-49.18,;23.55,-47.64,;24.88,-46.88,;24.89,-45.33,;26.22,-47.65,;27.43,-46.69,;27.09,-45.19,)\|
BDBM50438745	COC(=O)C[C@H]1CC[C@@H](CC1)c1ccc(cc1)N1CCOc2ncnc(N)c2C1=O \|r,wU:8.11,wD:5.4,(26.42,-40.68,;24.89,-40.46,;24.32,-39.03,;25.27,-37.83,;22.8,-38.81,;21.82,-40.05,;20.3,-39.83,;19.34,-41.03,;19.93,-42.49,;21.42,-42.68,;22.38,-41.48,;18.94,-43.73,;17.42,-43.5,;16.46,-44.71,;17.03,-46.16,;18.55,-46.36,;19.51,-45.16,;16.07,-47.38,;16.77,-48.78,;16.1,-50.19,;14.59,-50.56,;13.37,-49.59,;12.03,-50.39,;10.67,-49.62,;10.65,-48.07,;11.99,-47.27,;11.98,-45.72,;13.35,-48.04,;14.55,-47.05,;14.19,-45.54,)\|
BDBM50438698	Nc1ncnc2OCCN(c3ccc(cc3)C3CCN(CC3)C(=O)c3cnon3)C(=O)c12
BDBM50438699	Nc1ncnc2OCCN(Cc12)c1ccc(cc1)[C@H]1CC[C@H](CCO)CC1 \|r,wU:18.20,wD:21.24,(23.56,-14.58,;23.51,-16.13,;22.14,-16.86,;22.09,-18.41,;23.41,-19.22,;24.78,-18.49,;25.95,-19.5,;27.48,-19.2,;28.19,-17.82,;27.55,-16.4,;26.06,-16.02,;24.82,-16.95,;28.57,-15.21,;30.07,-15.5,;31.07,-14.34,;30.56,-12.85,;29.07,-12.6,;28.07,-13.76,;31.58,-11.67,;31.08,-10.22,;32.08,-9.06,;33.58,-9.32,;34.59,-8.15,;36.11,-8.44,;37.13,-7.26,;34.09,-10.79,;33.09,-11.96,)\|
BDBM50438700	CC(C)(C)[C@H]1CC[C@@H](CC1)N1CCOc2ncnc(N)c2C1=O \|r,wU:7.10,wD:4.3,(21.31,-37.71,;19.8,-37.41,;19.3,-35.95,;20.88,-36.31,;18.77,-38.58,;17.27,-38.29,;16.26,-39.45,;16.76,-40.91,;18.26,-41.18,;19.26,-40.03,;15.75,-42.07,;16.37,-43.49,;15.64,-44.85,;14.12,-45.15,;12.96,-44.13,;11.59,-44.86,;10.28,-44.04,;10.34,-42.49,;11.7,-41.77,;11.76,-40.23,;13.01,-42.59,;14.25,-41.68,;13.97,-40.16,)\|
BDBM50438702	Nc1ncnc2OCCN(c3ccc(cc3)C3CCN(CC3)C(=O)c3ccno3)C(=O)c12
BDBM50438703	Nc1nccc2OCCN(c3ccc(cc3)[C@H]3CC[C@H](CC(O)=O)CC3)C(=O)c12 \|r,wU:16.16,wD:19.20,(22.31,-47.39,;22.25,-48.93,;20.88,-49.64,;20.81,-51.18,;22.11,-52,;23.49,-51.29,;24.64,-52.31,;26.16,-52.03,;26.89,-50.67,;26.27,-49.24,;27.3,-48.07,;28.79,-48.37,;29.8,-47.23,;29.31,-45.75,;27.83,-45.48,;26.82,-46.62,;30.34,-44.58,;29.86,-43.14,;30.87,-42,;32.36,-42.27,;33.38,-41.11,;34.89,-41.42,;35.92,-40.25,;35.38,-42.87,;32.85,-43.74,;31.84,-44.88,;24.79,-48.85,;24.52,-47.33,;23.55,-49.76,)\|
BDBM50438704	Nc1ncnc2OCCN(c3ccc(cc3)C3CCN(CC3)C(=O)c3ccon3)C(=O)c12
BDBM50438705	Nc1ncnc2OCCN(c3ccc(cc3)[C@H]3CC[C@H](Cc4nnn[nH]4)CC3)C(=O)c12 \|r,wU:16.16,wD:19.20,(23.78,-52.15,;23.8,-53.69,;22.46,-54.48,;22.48,-56.03,;23.83,-56.79,;25.16,-56,;26.38,-56.96,;27.89,-56.59,;28.55,-55.2,;27.85,-53.8,;28.81,-52.58,;28.25,-51.14,;29.2,-49.94,;30.71,-50.17,;31.28,-51.59,;30.33,-52.79,;31.69,-48.94,;31.11,-47.48,;32.06,-46.28,;33.57,-46.51,;34.55,-45.27,;36.06,-45.49,;37.13,-44.36,;38.53,-45.04,;38.31,-46.57,;36.79,-46.84,;34.13,-47.92,;33.18,-49.12,;26.35,-53.47,;25.99,-51.97,;25.15,-54.45,)\|
BDBM50438706	C[C@H]1CN(c2ccc(cc2)[C@H]2CC[C@H](CC(O)=O)CC2)C(=O)c2c(N)ncnc2O1 \|r,wU:10.10,wD:1.0,13.14,(32.09,-54.04,;31.12,-52.84,;31.77,-51.44,;31.07,-50.04,;32.04,-48.82,;33.56,-49.04,;34.5,-47.85,;33.93,-46.39,;32.43,-46.2,;31.48,-47.4,;34.9,-45.16,;34.34,-43.75,;35.29,-42.55,;36.79,-42.74,;37.75,-41.53,;39.28,-41.76,;39.85,-43.19,;40.25,-40.54,;37.36,-44.19,;36.41,-45.39,;29.58,-49.73,;29.22,-48.22,;28.38,-50.71,;27.04,-49.95,;27.02,-48.4,;25.71,-50.73,;25.72,-52.27,;27.07,-53.03,;28.4,-52.24,;29.61,-53.2,)\|
BDBM50438707	CC(=O)N1CCC(CC1)c1ccc(cc1)N1CCOc2ncnc(N)c2C1=O
BDBM50438708	CC(C)C(=O)N1CCC(CC1)c1ccc(cc1)N1CCOc2ncnc(N)c2C1=O
BDBM50438709	Nc1ncnc2OCCN(c3ccc(cc3)C3CCN(CC3)C(=O)[C@@H]3CC[C@H](O)CC3)C(=O)c12 \|r,wD:27.29,24.25,(28.24,-51.09,;28.26,-52.64,;26.93,-53.42,;26.95,-54.96,;28.29,-55.72,;29.63,-54.93,;30.83,-55.89,;32.34,-55.52,;33,-54.13,;32.31,-52.74,;33.27,-51.52,;32.69,-50.09,;33.64,-48.89,;35.15,-49.11,;35.72,-50.53,;34.77,-51.73,;36.13,-47.88,;37.64,-48.1,;38.61,-46.88,;38.03,-45.42,;36.49,-45.24,;35.55,-46.43,;38.97,-44.23,;40.49,-44.45,;38.4,-42.78,;36.85,-42.54,;36.29,-41.13,;37.24,-39.93,;36.66,-38.49,;38.74,-40.15,;39.31,-41.57,;30.81,-52.41,;30.44,-50.91,;29.61,-53.39,)\|
BDBM50438710	Nc1ncnc2OCCN(c3ccc(cc3)C3CCN(CC3)C(=O)C3CCCCC3)C(=O)c12
BDBM50438711	Nc1ncnc2OCCN(c3ccc(cc3)C3CCN(CC3)C(=O)C3CCOCC3)C(=O)c12
BDBM50438712	CN(CC(O)=O)C(=O)C[C@H]1CC[C@@H](CC1)c1ccc(cc1)N1CCOc2ncnc(N)c2C1=O \|r,wU:12.15,wD:9.8,(30.02,-40.47,;28.5,-40.16,;28.01,-38.69,;29.03,-37.54,;30.54,-37.84,;28.54,-36.06,;27.48,-41.32,;27.98,-42.8,;25.97,-41.01,;24.93,-42.19,;23.45,-41.92,;22.44,-43.07,;22.92,-44.51,;24.42,-44.82,;25.44,-43.67,;21.88,-45.69,;22.38,-47.18,;21.37,-48.32,;19.87,-48.02,;19.39,-46.57,;20.4,-45.43,;18.83,-49.2,;19.46,-50.64,;18.73,-52,;17.2,-52.28,;16.04,-51.26,;14.67,-51.98,;13.35,-51.15,;13.43,-49.6,;14.79,-48.88,;14.86,-47.34,;16.1,-49.72,;17.35,-48.8,;17.07,-47.28,)\|
BDBM50438713	CCOCC(=O)N1CCC(CC1)c1ccc(cc1)N1CCOc2ncnc(N)c2C1=O
BDBM50438714	Cc1nnc(C[C@H]2CC[C@@H](CC2)c2ccc(cc2)N2CCOc3ncnc(N)c3C2=O)[nH]1 \|r,wU:9.12,wD:6.5,(30.61,-38.38,;29.24,-39.09,;28.98,-40.61,;27.46,-40.84,;26.76,-39.48,;25.25,-39.23,;24.25,-40.44,;22.75,-40.18,;21.78,-41.36,;22.32,-42.83,;23.81,-43.04,;24.78,-41.87,;21.32,-44.02,;19.82,-43.77,;18.84,-44.95,;19.38,-46.41,;20.89,-46.63,;21.86,-45.46,;18.4,-47.59,;19.04,-48.99,;18.39,-50.39,;16.86,-50.71,;15.67,-49.72,;14.32,-50.49,;12.99,-49.7,;13,-48.16,;14.35,-47.4,;14.37,-45.86,;15.68,-48.18,;16.9,-47.24,;16.58,-45.72,;27.86,-38.38,)\|
BDBM50438715	Cc1nnc(C[C@H]2CC[C@@H](CC2)c2ccc(cc2)N2CCOc3ncnc(N)c3C2=O)n1C \|r,wU:9.12,wD:6.5,(38.85,-39.38,;37.52,-40.15,;37.35,-41.69,;35.84,-42.02,;35.06,-40.7,;33.54,-40.54,;32.62,-41.8,;31.1,-41.63,;30.2,-42.86,;30.83,-44.3,;32.33,-44.42,;33.23,-43.19,;29.9,-45.56,;28.39,-45.39,;27.48,-46.63,;28.1,-48.05,;29.62,-48.19,;30.52,-46.96,;27.18,-49.3,;27.93,-50.66,;27.32,-52.08,;25.83,-52.51,;24.58,-51.59,;23.28,-52.43,;21.91,-51.72,;21.83,-50.17,;23.13,-49.34,;23.06,-47.8,;24.51,-50.05,;25.67,-49.03,;25.25,-47.54,;36.09,-39.53,;35.77,-38.01,)\|
BDBM50438716	Nc1ncnc2OCCN(c3ccc(cc3)C3CCN(CC3)C(=O)c3ccccc3)C(=O)c12
BDBM50438717	Nc1ncnc2OCCN(c3ccc(cc3)[C@H]3CC[C@H](CC(=O)N4CC(O)C4)CC3)C(=O)c12 \|r,wU:16.16,wD:19.20,(24.81,-51.13,;24.79,-52.69,;23.43,-53.45,;23.41,-55.01,;24.75,-55.8,;26.11,-55.03,;27.3,-56.03,;28.82,-55.7,;29.52,-54.31,;28.86,-52.9,;29.86,-51.7,;29.31,-50.24,;30.3,-49.05,;31.81,-49.32,;32.35,-50.76,;31.37,-51.93,;32.82,-48.1,;32.28,-46.63,;33.26,-45.45,;34.77,-45.71,;35.78,-44.5,;37.29,-44.76,;37.82,-46.2,;38.3,-43.55,;38.16,-41.99,;39.67,-41.85,;40.67,-40.64,;39.81,-43.38,;35.3,-47.15,;34.32,-48.33,;27.36,-52.53,;27.03,-51.01,;26.12,-53.48,)\|
BDBM50438718	Cc1nnc(C[C@H]2CC[C@@H](CC2)c2ccc(cc2)N2CCOc3ncnc(N)c3C2=O)o1 \|r,wU:9.12,wD:6.5,(28.43,-43.63,;27.33,-42.54,;27.59,-41.02,;26.2,-40.32,;25.1,-41.43,;23.6,-41.18,;22.61,-42.39,;21.1,-42.14,;20.14,-43.32,;20.68,-44.78,;22.17,-45,;23.15,-43.82,;19.69,-45.99,;18.19,-45.74,;17.21,-46.92,;17.76,-48.37,;19.26,-48.6,;20.23,-47.42,;16.77,-49.57,;17.42,-50.96,;16.78,-52.36,;15.25,-52.69,;14.05,-51.71,;12.71,-52.48,;11.37,-51.7,;11.39,-50.15,;12.73,-49.39,;12.74,-47.85,;14.06,-50.17,;15.27,-49.22,;14.94,-47.71,;25.81,-42.79,)\|
BDBM50438719	Cc1nnc(C[C@H]2CC[C@@H](CC2)c2ccc(cc2)N2CCOc3ncnc(N)c3C2=O)s1 \|r,wU:9.12,wD:6.5,(28.13,-42.45,;26.99,-41.4,;27.19,-39.86,;25.78,-39.21,;24.72,-40.37,;23.21,-40.18,;22.27,-41.42,;20.75,-41.23,;19.83,-42.45,;20.43,-43.88,;21.93,-44.05,;22.86,-42.83,;19.49,-45.13,;17.97,-44.93,;17.05,-46.16,;17.64,-47.58,;19.15,-47.76,;20.08,-46.54,;16.71,-48.82,;17.4,-50.18,;16.82,-51.61,;15.3,-51.99,;14.07,-51.06,;12.76,-51.88,;11.39,-51.15,;11.34,-49.6,;12.66,-48.79,;12.61,-47.25,;14.02,-49.52,;15.19,-48.52,;14.81,-47.03,;25.48,-41.7,)\|
BDBM50438720	CN1CCN(CC1=O)C(=O)C[C@H]1CC[C@@H](CC1)c1ccc(cc1)N1CCOc2ncnc(N)c2C1=O \|r,wU:14.18,wD:11.11,(42.23,-35.63,;41.19,-36.81,;41.69,-38.27,;40.68,-39.42,;39.19,-39.16,;38.68,-37.67,;39.69,-36.51,;39.19,-35.03,;38.15,-40.35,;38.64,-41.8,;36.64,-40.05,;35.61,-41.23,;34.1,-40.93,;33.09,-42.09,;33.59,-43.58,;35.09,-43.84,;36.1,-42.68,;32.56,-44.76,;31.05,-44.46,;30.03,-45.62,;30.54,-47.1,;32.04,-47.37,;33.06,-46.22,;29.51,-48.27,;30.13,-49.7,;29.4,-51.08,;27.87,-51.36,;26.7,-50.34,;25.32,-51.07,;24.01,-50.24,;24.07,-48.69,;25.44,-47.96,;25.5,-46.4,;26.75,-48.79,;28.01,-47.87,;27.73,-46.34,)\|
BDBM50438721	Nc1ncnc2OCCN(c3ccc(cc3)[C@H]3CC[C@H](CC(=O)N4CC[C@@H](O)C4)CC3)C(=O)c12 \|r,wU:16.16,wD:26.27,19.20,(19.71,-48.18,;19.76,-49.73,;18.45,-50.55,;18.5,-52.09,;19.87,-52.82,;21.18,-51.99,;22.42,-52.92,;23.92,-52.52,;24.53,-51.1,;23.81,-49.73,;24.74,-48.5,;24.14,-47.07,;25.06,-45.84,;26.57,-46.03,;27.17,-47.43,;26.26,-48.65,;27.51,-44.78,;26.9,-43.34,;27.82,-42.12,;29.33,-42.3,;30.27,-41.05,;31.78,-41.23,;32.38,-42.64,;32.72,-39.99,;34.25,-39.98,;34.73,-38.52,;33.5,-37.6,;33.51,-36.06,;32.24,-38.5,;29.93,-43.7,;29.01,-44.92,;22.3,-49.44,;21.9,-47.96,;21.13,-50.45,)\|
BDBM50438722	CC1(C)CN(c2ccc(cc2)[C@H]2CC[C@H](CC(O)=O)CC2)C(=O)c2c(N)ncnc2O1 \|r,wU:11.11,wD:14.15,(25.71,-50.99,;24.21,-50.62,;24.18,-52.16,;24.9,-49.24,;24.24,-47.82,;25.24,-46.63,;26.75,-46.9,;27.73,-45.73,;27.2,-44.26,;25.71,-44.03,;24.73,-45.2,;28.2,-43.07,;27.67,-41.64,;28.65,-40.47,;30.15,-40.7,;31.14,-39.52,;32.66,-39.79,;33.66,-38.6,;33.19,-41.23,;30.68,-42.17,;29.7,-43.33,;22.76,-47.47,;22.45,-45.96,;21.54,-48.41,;20.22,-47.62,;20.25,-46.08,;18.87,-48.36,;18.83,-49.91,;20.16,-50.7,;21.52,-49.95,;22.7,-50.94,)\|
BDBM50438723	CC(C)(C)c1ccc(cc1)N1CCOc2ncnc(N)c2C1=O
BDBM50438724	Nc1ncnc2OCCN(c3ccc(cc3)[C@H]3CC[C@H](CCC(O)=O)CC3)C(=O)c12 \|r,wU:16.16,wD:19.20,(10.74,-43.8,;10.71,-45.35,;9.35,-46.09,;9.32,-47.63,;10.64,-48.44,;12,-47.69,;13.18,-48.7,;14.7,-48.38,;15.4,-47,;14.74,-45.58,;15.76,-44.38,;17.26,-44.66,;18.25,-43.5,;17.73,-42.02,;16.23,-41.78,;15.24,-42.95,;18.74,-40.83,;18.22,-39.39,;19.21,-38.22,;20.71,-38.46,;21.72,-37.27,;23.23,-37.55,;24.23,-36.37,;25.75,-36.65,;23.71,-34.91,;21.23,-39.93,;20.24,-41.1,;13.26,-45.22,;12.96,-43.7,;12.03,-46.15,)\|
BDBM50438725	Nc1ncnc2OCCN(c3ccc(cc3)[C@H]3CC[C@H](CC(=O)N4CCCC4)CC3)C(=O)c12 \|r,wU:16.16,wD:19.20,(21.03,-46.19,;21.01,-47.73,;19.67,-48.48,;19.65,-50.03,;20.99,-50.81,;22.33,-50.05,;23.52,-51.03,;25.04,-50.71,;25.72,-49.32,;25.04,-47.91,;26.04,-46.71,;27.54,-46.96,;28.51,-45.79,;27.97,-44.32,;26.48,-44.11,;25.51,-45.28,;28.96,-43.12,;28.43,-41.7,;29.4,-40.52,;30.9,-40.74,;31.88,-39.55,;33.4,-39.81,;33.94,-41.25,;34.39,-38.62,;35.93,-38.71,;36.51,-37.26,;35.31,-36.27,;34,-37.1,;31.44,-42.2,;30.46,-43.38,;23.56,-47.57,;23.23,-46.06,;22.34,-48.52,)\|
BDBM50438726	Nc1ccnc2OCCN(c3ccc(cc3)[C@H]3CC[C@H](CC(O)=O)CC3)C(=O)c12 \|r,wU:16.16,wD:19.20,(25.66,-48.71,;25.59,-50.24,;24.22,-50.95,;24.14,-52.49,;25.45,-53.32,;26.82,-52.61,;27.98,-53.64,;29.5,-53.36,;30.23,-52,;29.61,-50.57,;30.65,-49.4,;32.14,-49.71,;33.15,-48.57,;32.66,-47.09,;31.18,-46.82,;30.16,-47.95,;33.7,-45.92,;33.22,-44.48,;34.23,-43.34,;35.72,-43.61,;36.75,-42.46,;38.25,-42.77,;39.29,-41.61,;38.74,-44.22,;36.2,-45.09,;35.19,-46.23,;28.14,-50.17,;27.87,-48.65,;26.89,-51.08,)\|
BDBM50438727	Nc1ncnc2OCCN(c3ccc(cc3)[C@H]3CC[C@H](CC(=O)N4CCOCC4)CC3)C(=O)c12 \|r,wU:16.16,wD:19.20,(26.47,-50.14,;26.49,-51.7,;25.15,-52.5,;25.18,-54.05,;26.53,-54.81,;27.88,-54.01,;29.1,-54.96,;30.61,-54.6,;31.26,-53.18,;30.57,-51.79,;31.53,-50.57,;30.95,-49.12,;31.9,-47.91,;33.42,-48.13,;34,-49.55,;33.05,-50.76,;34.4,-46.89,;33.81,-45.43,;34.76,-44.22,;36.28,-44.44,;37.25,-43.2,;38.77,-43.42,;39.34,-44.85,;39.75,-42.18,;39.16,-40.72,;40.11,-39.51,;41.63,-39.73,;42.2,-41.16,;41.25,-42.36,;36.85,-45.87,;35.9,-47.07,;29.05,-51.47,;28.68,-49.96,;27.85,-52.45,)\|
BDBM50438728	CCNC(=O)C[C@H]1CC[C@@H](CC1)c1ccc(cc1)N1CCOc2ncnc(N)c2C1=O \|r,wU:9.12,wD:6.5,(39.91,-37.08,;38.91,-38.29,;37.4,-38.03,;36.41,-39.22,;36.95,-40.66,;34.89,-38.97,;33.9,-40.16,;32.4,-39.94,;31.43,-41.11,;31.96,-42.54,;33.46,-42.8,;34.44,-41.62,;30.96,-43.75,;31.5,-45.22,;30.53,-46.39,;29.03,-46.14,;28.5,-44.71,;29.47,-43.53,;28.03,-47.34,;28.71,-48.76,;28.02,-50.15,;26.5,-50.48,;25.31,-49.49,;23.96,-50.25,;22.63,-49.47,;22.65,-47.92,;23.99,-47.16,;24.01,-45.62,;25.32,-47.95,;26.54,-47,;26.22,-45.49,)\|
BDBM50438729	CC(C)[C@H](CO)NC(=O)C[C@H]1CC[C@@H](CC1)c1ccc(cc1)N1CCOc2ncnc(N)c2C1=O \|r,wU:3.5,13.16,wD:10.9,(35.51,-41.58,;36.49,-40.39,;38.01,-40.66,;35.96,-38.95,;36.95,-37.77,;38.47,-38.03,;34.45,-38.69,;33.46,-39.89,;34,-41.32,;31.94,-39.63,;30.96,-40.82,;29.46,-40.6,;28.48,-41.77,;29.01,-43.2,;30.52,-43.46,;31.49,-42.28,;28.02,-44.41,;28.56,-45.87,;27.59,-47.05,;26.09,-46.8,;25.56,-45.37,;26.53,-44.19,;25.09,-48,;25.76,-49.42,;25.08,-50.8,;23.56,-51.13,;22.37,-50.14,;21.03,-50.91,;19.69,-50.13,;19.71,-48.57,;21.05,-47.82,;21.07,-46.28,;22.38,-48.61,;23.6,-47.66,;23.28,-46.14,)\|
BDBM50438730	Cc1noc(CC[C@H]2CC[C@@H](CC2)c2ccc(cc2)N2CCOc3ncnc(N)c3C2=O)n1 \|r,wU:10.13,wD:7.6,(40.74,-42.42,;39.26,-42.85,;38.05,-41.9,;36.77,-42.77,;37.22,-44.27,;36.25,-45.5,;34.74,-45.28,;33.77,-46.51,;32.26,-46.28,;31.32,-47.48,;31.9,-48.94,;33.39,-49.12,;34.34,-47.92,;30.94,-50.16,;29.42,-49.94,;28.48,-51.14,;29.05,-52.58,;30.56,-52.78,;31.5,-51.58,;28.09,-53.79,;28.79,-55.18,;28.14,-56.58,;26.64,-56.95,;25.42,-55.99,;24.09,-56.78,;22.74,-56.03,;22.72,-54.49,;24.05,-53.7,;24.03,-52.16,;25.4,-54.45,;26.59,-53.47,;26.22,-51.97,;38.74,-44.3,)\|
BDBM50438731	CC(C)(N)C[C@H]1CC[C@@H](CC1)c1ccc(cc1)N1CCOc2ncnc(N)c2C1=O \|r,wU:8.11,wD:5.4,(38.06,-43.71,;37.56,-42.25,;38.58,-41.09,;39.04,-42.64,;36.07,-41.95,;35.03,-43.12,;33.53,-42.83,;32.52,-43.97,;33.02,-45.46,;34.51,-45.72,;35.52,-44.57,;31.99,-46.63,;30.49,-46.33,;29.47,-47.49,;29.97,-48.96,;31.47,-49.23,;32.48,-48.08,;28.95,-50.12,;29.57,-51.55,;28.84,-52.91,;27.32,-53.2,;26.15,-52.17,;24.77,-52.9,;23.47,-52.08,;23.53,-50.52,;24.9,-49.81,;24.96,-48.26,;26.21,-50.64,;27.46,-49.72,;27.18,-48.2,)\|
BDBM50020044	CCc1ccccc1NC(=O)N1C[C@@H](C)Oc2cc(ccc12)-c1ccc(cc1)[C@H]1CC[C@H](CC(O)=O)CC1 \|r,wU:28.31,13.14,wD:31.35,(3.45,-11.77,;3.48,-13.31,;4.83,-14.05,;4.86,-15.59,;6.21,-16.33,;7.53,-15.52,;7.49,-13.98,;6.14,-13.26,;6.11,-11.72,;7.42,-10.91,;8.77,-11.65,;7.38,-9.37,;6.03,-8.64,;6,-7.1,;4.65,-6.36,;7.32,-6.29,;8.67,-7.04,;9.98,-6.23,;11.33,-6.98,;11.37,-8.52,;10.06,-9.31,;8.7,-8.58,;12.65,-6.17,;14,-6.92,;15.31,-6.11,;15.27,-4.57,;13.92,-3.84,;12.61,-4.63,;16.59,-3.78,;16.55,-2.23,;17.87,-1.43,;19.22,-2.18,;20.53,-1.37,;21.88,-2.1,;23.19,-1.3,;21.92,-3.64,;19.26,-3.72,;17.94,-4.51,)\|
BDBM50020045	C[C@@H]1CN(C(=O)Nc2ccccc2)c2ccc(cc2O1)-c1ccc(cc1)[C@H]1CC[C@H](CC(O)=O)CC1 \|r,wU:26.29,1.0,wD:29.33,(3.83,-10.05,;5.18,-10.79,;5.22,-12.33,;6.57,-13.07,;6.61,-14.61,;7.95,-15.34,;5.29,-15.41,;5.33,-16.94,;4.01,-17.74,;4.05,-19.28,;5.4,-20.01,;6.71,-19.21,;6.68,-17.68,;7.88,-12.27,;9.23,-13.01,;10.55,-12.21,;10.51,-10.67,;9.16,-9.93,;7.85,-10.73,;6.5,-9.99,;11.83,-9.87,;11.79,-8.33,;13.1,-7.53,;14.45,-8.27,;14.49,-9.81,;13.18,-10.61,;15.77,-7.47,;15.73,-5.93,;17.04,-5.13,;18.39,-5.87,;19.71,-5.07,;19.67,-3.53,;20.99,-2.73,;18.32,-2.79,;18.43,-7.41,;17.12,-8.21,)\|
BDBM50020046	OC(=O)C[C@H]1CC[C@@H](CC1)c1ccc(cc1)-c1ccc2N(CCOc2c1)C(=O)Nc1ccc(F)cc1C(F)(F)F \|r,wU:4.3,wD:7.10,(21.59,-12.75,;22.36,-11.41,;23.9,-11.41,;21.59,-10.08,;20.05,-10.08,;19.28,-11.41,;17.74,-11.41,;16.97,-10.08,;17.74,-8.74,;19.28,-8.74,;15.43,-10.08,;14.66,-11.41,;13.12,-11.41,;12.35,-10.08,;13.12,-8.74,;14.66,-8.74,;10.81,-10.08,;10.04,-8.74,;8.5,-8.74,;7.73,-10.08,;6.19,-10.08,;5.42,-11.41,;6.19,-12.75,;7.73,-12.75,;8.5,-11.41,;10.04,-11.41,;5.42,-8.74,;6.19,-7.41,;3.88,-8.74,;3.11,-7.41,;3.88,-6.08,;3.11,-4.74,;1.57,-4.74,;.8,-3.41,;.8,-6.08,;1.57,-7.41,;.8,-8.74,;-.62,-8.96,;1.42,-10.14,;.03,-10.08,)\|
BDBM50020047	CC1CN(C(=O)Nc2ccccc2)c2ccc(cc2O1)-c1ccc(cc1)[C@H]1CC[C@H](CC(O)=O)CC1 \|r,wU:26.29,wD:29.33,(3.83,-10.05,;5.18,-10.79,;5.22,-12.33,;6.57,-13.07,;6.61,-14.61,;7.95,-15.34,;5.29,-15.41,;5.33,-16.94,;4.01,-17.74,;4.05,-19.28,;5.4,-20.01,;6.71,-19.21,;6.68,-17.68,;7.88,-12.27,;9.23,-13.01,;10.55,-12.21,;10.51,-10.67,;9.16,-9.93,;7.85,-10.73,;6.5,-9.99,;11.83,-9.87,;11.79,-8.33,;13.1,-7.53,;14.45,-8.27,;14.49,-9.81,;13.18,-10.61,;15.77,-7.47,;15.73,-5.93,;17.04,-5.13,;18.39,-5.87,;19.71,-5.07,;19.67,-3.53,;20.99,-2.73,;18.32,-2.79,;18.43,-7.41,;17.12,-8.21,)\|
BDBM50020048	OC(=O)C[C@H]1CC[C@@H](CC1)c1ccc(cc1)-c1ccc2N(CCOc2c1)C(=O)Nc1ccccc1C(F)(F)F \|r,wU:4.3,wD:7.10,(23.18,-11.66,;21.64,-11.66,;20.87,-12.99,;20.87,-10.32,;19.33,-10.32,;18.56,-11.66,;17.02,-11.66,;16.25,-10.32,;17.02,-8.99,;18.56,-8.99,;14.71,-10.32,;13.94,-11.66,;12.4,-11.66,;11.63,-10.32,;12.4,-8.99,;13.94,-8.99,;10.09,-10.32,;9.32,-8.99,;7.78,-8.99,;7.01,-10.32,;5.47,-10.32,;4.7,-11.66,;5.47,-12.99,;7.01,-12.99,;7.78,-11.66,;9.32,-11.66,;4.7,-8.99,;5.47,-7.66,;3.16,-8.99,;2.39,-7.66,;3.16,-6.32,;2.39,-4.99,;.85,-4.99,;.08,-6.32,;.85,-7.66,;.08,-8.99,;.61,-10.39,;-.69,-10.32,;-1.52,-9.56,)\|
BDBM50020049	CCCCCCCNC(=O)N1CCOc2cc(ccc12)-c1ccc(cc1)[C@H]1CC[C@H](CC(O)=O)CC1 \|r,wU:26.28,wD:29.32,(3.09,-11.07,;4.44,-11.81,;4.46,-13.35,;5.81,-14.1,;7.12,-13.31,;7.1,-11.77,;5.74,-11.03,;5.71,-9.5,;7.03,-8.7,;8.37,-9.43,;6.99,-7.16,;5.64,-6.41,;5.6,-4.87,;6.91,-4.07,;8.27,-4.81,;9.58,-4.01,;10.93,-4.75,;10.97,-6.3,;9.66,-7.1,;8.3,-6.36,;12.25,-3.95,;12.21,-2.41,;13.53,-1.61,;14.88,-2.35,;14.92,-3.89,;13.6,-4.7,;16.19,-1.55,;16.16,-.01,;17.47,.8,;18.83,.06,;20.14,.86,;20.1,2.4,;21.42,3.2,;18.75,3.14,;18.86,-1.49,;17.55,-2.29,)\|
BDBM50020050	CCc1ccccc1NC(=O)N1CCOc2cc(ccc12)-c1ccc(cc1)[C@H]1CC[C@H](CC(O)=O)CC1 \|r,wU:30.34,wD:27.30,(.52,-9.03,;2.06,-9.03,;2.83,-7.69,;2.06,-6.36,;2.83,-5.03,;4.37,-5.03,;5.14,-6.36,;4.37,-7.69,;5.14,-9.03,;6.68,-9.03,;7.45,-7.69,;7.45,-10.36,;6.68,-11.7,;7.45,-13.03,;8.99,-13.03,;9.76,-11.7,;11.3,-11.7,;12.07,-10.36,;11.3,-9.03,;9.76,-9.03,;8.99,-10.36,;13.61,-10.36,;14.38,-11.7,;15.92,-11.7,;16.69,-10.36,;15.92,-9.03,;14.38,-9.03,;18.23,-10.36,;19,-11.7,;20.54,-11.7,;21.31,-10.36,;22.85,-10.36,;23.62,-11.7,;25.16,-11.7,;22.85,-13.03,;20.54,-9.03,;19,-9.03,)\|
BDBM50020051	CCOc1ccc(NC(=O)N2CCOc3cc(ccc23)-c2ccc(cc2)[C@H]2CC[C@H](CC(O)=O)CC2)cc1 \|r,wU:29.32,wD:26.28,(-1.18,-9.52,;.15,-10.29,;1.49,-9.52,;2.82,-10.29,;2.82,-11.83,;4.16,-12.6,;5.49,-11.83,;6.82,-12.6,;8.16,-11.83,;8.16,-10.29,;9.49,-12.6,;9.49,-14.14,;10.82,-14.91,;12.16,-14.14,;12.16,-12.6,;13.49,-11.83,;13.49,-10.29,;12.16,-9.52,;10.82,-10.29,;10.82,-11.83,;14.82,-9.52,;16.16,-10.29,;17.49,-9.52,;17.49,-7.98,;16.16,-7.21,;14.82,-7.98,;18.83,-7.21,;20.16,-7.98,;21.49,-7.21,;21.49,-5.67,;22.83,-4.9,;24.16,-5.67,;25.49,-4.9,;24.16,-7.21,;20.16,-4.9,;18.83,-5.67,;5.49,-10.29,;4.16,-9.52,)\|
BDBM50020052	OC(=O)C[C@H]1CC[C@@H](CC1)c1ccc(cc1)-c1ccc2N(CCOc2c1)C(=O)NCCCCc1ccccc1 \|r,wU:7.10,wD:4.3,(22.51,3.03,;21.2,2.23,;19.85,2.96,;21.24,.69,;19.92,-.12,;18.57,.63,;17.25,-.18,;17.29,-1.72,;18.64,-2.46,;19.96,-1.66,;15.98,-2.52,;14.63,-1.78,;13.31,-2.58,;13.35,-4.12,;14.7,-4.86,;16.01,-4.06,;12.03,-4.92,;12.07,-6.46,;10.76,-7.26,;9.4,-6.52,;8.09,-7.32,;6.74,-6.58,;6.7,-5.04,;8.02,-4.24,;9.37,-4.98,;10.68,-4.18,;8.13,-8.86,;9.47,-9.6,;6.81,-9.66,;6.84,-11.2,;5.53,-12,;5.58,-13.53,;4.27,-14.34,;4.31,-15.87,;3,-16.68,;3.05,-18.22,;4.4,-18.95,;5.72,-18.13,;5.67,-16.6,)\|
BDBM50020053	CCC1CN(C(=O)Nc2ccccc2)c2ccc(cc2O1)-c1ccc(cc1)[C@H]1CC[C@H](CC(O)=O)CC1 \|r,wU:27.30,wD:30.34,(2.93,-11.98,;4.47,-11.98,;5.24,-10.65,;4.47,-9.32,;5.24,-7.98,;4.47,-6.65,;5.24,-5.31,;2.93,-6.65,;2.16,-5.31,;.62,-5.31,;-.15,-3.98,;.62,-2.65,;2.16,-2.65,;2.93,-3.98,;6.78,-7.98,;7.55,-6.65,;9.09,-6.65,;9.86,-7.98,;9.09,-9.32,;7.55,-9.32,;6.78,-10.65,;11.4,-7.98,;12.17,-9.32,;13.71,-9.32,;14.48,-7.98,;13.71,-6.65,;12.17,-6.65,;16.02,-7.98,;16.79,-6.65,;18.33,-6.65,;19.1,-7.98,;20.64,-7.98,;21.41,-9.32,;22.95,-9.32,;20.64,-10.65,;18.33,-9.32,;16.79,-9.32,)\|
BDBM50020054	OC(=O)C[C@H]1CC[C@H](CC1)c1ccc(cc1)-c1ccc2N(CCOc2c1)C(=O)Nc1ccccc1 \|r,wU:7.10,4.3,(19.8,-5.61,;18.48,-6.41,;17.13,-5.67,;18.52,-7.95,;17.21,-8.75,;17.24,-10.29,;15.93,-11.08,;14.58,-10.34,;14.54,-8.8,;15.86,-8.01,;13.26,-11.14,;11.91,-10.4,;10.6,-11.2,;10.64,-12.74,;11.99,-13.48,;13.3,-12.68,;9.32,-13.54,;9.36,-15.08,;8.05,-15.88,;6.7,-15.14,;5.38,-15.94,;4.03,-15.2,;3.99,-13.66,;5.31,-12.86,;6.66,-13.6,;7.97,-12.8,;5.42,-17.48,;6.76,-18.21,;4.1,-18.28,;4.14,-19.82,;2.82,-20.61,;2.86,-22.15,;4.21,-22.89,;5.53,-22.08,;5.49,-20.55,)\|
BDBM50020055	CCc1ccccc1NC(=O)N1CC(C)Oc2cc(ccc12)-c1ccc(cc1)[C@H]1CC[C@H](CC(O)=O)CC1 \|r,wU:28.31,wD:31.35,(4.09,-13.01,;4.12,-14.54,;5.46,-15.28,;5.5,-16.82,;6.85,-17.56,;8.16,-16.75,;8.12,-15.21,;6.78,-14.49,;6.74,-12.95,;8.06,-12.14,;9.41,-12.88,;8.02,-10.6,;6.67,-9.87,;6.63,-8.33,;5.28,-7.59,;7.95,-7.52,;9.3,-8.27,;10.62,-7.46,;11.97,-8.21,;12,-9.75,;10.69,-10.54,;9.34,-9.81,;13.28,-7.4,;14.63,-8.15,;15.94,-7.34,;15.91,-5.8,;14.56,-5.07,;13.24,-5.86,;17.22,-5.01,;17.18,-3.47,;18.5,-2.66,;19.85,-3.41,;21.17,-2.6,;22.52,-3.34,;23.82,-2.53,;22.55,-4.87,;19.89,-4.95,;18.58,-5.74,)\|
BDBM50020056	CCc1ccccc1NC(=O)N1C[C@H](C)Oc2cc(ccc12)-c1ccc(cc1)[C@H]1CC[C@H](CC(O)=O)CC1 \|r,wU:28.31,wD:31.35,13.14,(3.45,-11.77,;3.48,-13.31,;4.83,-14.05,;4.86,-15.58,;6.21,-16.33,;7.53,-15.52,;7.49,-13.98,;6.14,-13.26,;6.11,-11.72,;7.42,-10.91,;8.77,-11.65,;7.38,-9.37,;6.03,-8.64,;6,-7.1,;4.65,-6.36,;7.32,-6.29,;8.67,-7.04,;9.98,-6.23,;11.33,-6.98,;11.37,-8.52,;10.06,-9.31,;8.7,-8.58,;12.65,-6.17,;14,-6.92,;15.31,-6.11,;15.27,-4.57,;13.92,-3.84,;12.61,-4.63,;16.59,-3.78,;16.55,-2.23,;17.87,-1.43,;19.22,-2.18,;20.53,-1.37,;21.88,-2.1,;23.19,-1.3,;21.92,-3.64,;19.26,-3.72,;17.94,-4.51,)\|
BDBM50020057	CCCC1CN(C(=O)Nc2ccccc2)c2ccc(cc2O1)-c1ccc(cc1)[C@H]1CC[C@H](CC(O)=O)CC1 \|r,wU:31.35,wD:28.31,(21.83,-1.51,;21.06,-2.85,;19.52,-2.85,;18.75,-4.18,;19.52,-5.51,;18.75,-6.85,;19.52,-8.18,;18.75,-9.51,;21.06,-8.18,;21.83,-9.51,;23.37,-9.51,;24.14,-10.85,;23.37,-12.18,;21.83,-12.18,;21.06,-10.85,;17.21,-6.85,;16.44,-8.18,;14.9,-8.18,;14.13,-6.85,;14.9,-5.51,;16.44,-5.51,;17.21,-4.18,;12.59,-6.85,;11.82,-5.51,;10.28,-5.51,;9.51,-6.85,;10.28,-8.18,;11.82,-8.18,;7.97,-6.85,;7.2,-5.51,;5.66,-5.51,;4.89,-6.85,;3.35,-6.85,;2.58,-5.51,;1.04,-5.51,;3.35,-4.18,;5.66,-8.18,;7.2,-8.18,)\|
BDBM50020058	OC(=O)C[C@H]1CC[C@@H](CC1)c1ccc(cc1)-c1ccc2N(CCOc2c1)C(=O)NC1CCCCC1 \|r,wU:7.10,wD:4.3,(22.51,3.03,;21.2,2.23,;19.84,2.96,;21.23,.69,;19.92,-.12,;18.57,.63,;17.25,-.18,;17.29,-1.72,;18.64,-2.46,;19.95,-1.66,;15.97,-2.52,;14.62,-1.78,;13.31,-2.58,;13.35,-4.12,;14.7,-4.86,;16.01,-4.06,;12.03,-4.92,;12.07,-6.46,;10.75,-7.26,;9.4,-6.52,;8.09,-7.32,;6.74,-6.58,;6.7,-5.04,;8.01,-4.24,;9.37,-4.98,;10.68,-4.18,;8.12,-8.86,;9.47,-9.6,;6.81,-9.66,;6.84,-11.2,;5.54,-11.99,;5.56,-13.52,;6.91,-14.26,;8.22,-13.47,;8.19,-11.93,)\|
BDBM50020059	O=C(Nc1ccccc1)N1CCOc2cc(ccc12)-c1ccc(cc1)[C@H]1CC[C@H](Cc2nnn[nH]2)CC1 \|r,wU:25.28,wD:28.32,(8.34,-16.89,;6.99,-16.15,;5.67,-16.95,;5.71,-18.49,;4.39,-19.28,;4.43,-20.82,;5.78,-21.56,;7.1,-20.75,;7.05,-19.22,;6.95,-14.61,;5.6,-13.87,;5.56,-12.33,;6.88,-11.53,;8.23,-12.27,;9.55,-11.47,;10.9,-12.21,;10.93,-13.75,;9.62,-14.55,;8.27,-13.81,;12.21,-11.41,;13.56,-12.15,;14.87,-11.35,;14.84,-9.81,;13.49,-9.07,;12.17,-9.87,;16.15,-9.01,;16.11,-7.47,;17.43,-6.67,;18.78,-7.41,;20.1,-6.61,;21.45,-7.34,;22.83,-6.68,;23.88,-7.79,;23.15,-9.14,;21.64,-8.86,;18.82,-8.95,;17.51,-9.75,)\|
BDBM50020060	[H][C@@]1(CC[C@@H](CC1)c1ccc(cc1)-c1ccc2N(CCOc2c1)C(=O)Nc1ccccc1)C(C)C(O)=O \|r,wU:4.7,1.0,(35.97,-15.33,;35.2,-16.67,;34.43,-15.33,;32.89,-15.33,;32.12,-16.67,;32.89,-18,;34.43,-18,;30.58,-16.67,;29.81,-18,;28.27,-18,;27.5,-16.67,;28.27,-15.33,;29.81,-15.33,;25.96,-16.67,;25.19,-15.33,;23.65,-15.33,;22.88,-16.67,;21.34,-16.67,;20.57,-18,;21.34,-19.34,;22.88,-19.34,;23.65,-18,;25.19,-18,;20.57,-15.33,;21.34,-14,;19.03,-15.33,;18.26,-14,;19.03,-12.67,;18.26,-11.33,;16.72,-11.33,;15.95,-12.67,;16.72,-14,;36.74,-16.67,;37.51,-18,;37.51,-15.33,;36.74,-14,;39.05,-15.33,)\|
BDBM50020061	CCC1CN(C(=O)Nc2ccccc2)c2ccc(cc2O1)-c1ccc(OC[C@H]2C[C@@H]2C(O)=O)nc1 \|r\|
BDBM50020062	CCC1CN(C(=O)Nc2ccccc2)c2ccc(cc2O1)-c1ccc(OCC2(CCC2)C(O)=O)nc1
BDBM50020063	ONC(=O)C[C@H]1CC[C@@H](CC1)c1ccc(cc1)-c1ccc2N(CCOc2c1)C(=O)Nc1ccccc1 \|r,wU:8.11,wD:5.4,(23.03,-4.59,;23.07,-6.13,;21.75,-6.93,;20.4,-6.19,;21.79,-8.47,;20.47,-9.27,;19.12,-8.52,;17.81,-9.32,;17.85,-10.86,;19.2,-11.6,;20.51,-10.8,;16.53,-11.66,;15.18,-10.92,;13.87,-11.72,;13.91,-13.26,;15.26,-14,;16.57,-13.2,;12.59,-14.06,;12.63,-15.6,;11.32,-16.4,;9.96,-15.66,;8.65,-16.46,;7.3,-15.72,;7.26,-14.18,;8.58,-13.38,;9.93,-14.12,;11.24,-13.32,;8.69,-18,;10.03,-18.73,;7.37,-18.8,;7.41,-20.34,;6.09,-21.13,;6.13,-22.67,;7.48,-23.41,;8.8,-22.6,;8.76,-21.07,)\|
BDBM50020064	CC(C)C1CN(C(=O)Nc2ccccc2)c2ccc(cc2O1)-c1ccc(cc1)[C@H]1CC[C@H](CC(O)=O)CC1 \|r,wU:31.35,wD:28.31,(17.6,-1.43,;18.37,-2.77,;19.91,-2.77,;17.6,-4.1,;18.37,-5.44,;17.6,-6.77,;18.37,-8.1,;17.6,-9.44,;19.91,-8.1,;20.68,-9.44,;22.22,-9.44,;22.99,-10.77,;22.22,-12.1,;20.68,-12.1,;19.91,-10.77,;16.06,-6.77,;15.29,-8.1,;13.75,-8.1,;12.98,-6.77,;13.75,-5.44,;15.29,-5.44,;16.06,-4.1,;11.44,-6.77,;10.67,-5.44,;9.13,-5.44,;8.36,-6.77,;9.13,-8.1,;10.67,-8.1,;6.82,-6.77,;6.05,-5.44,;4.51,-5.44,;3.74,-6.77,;2.2,-6.77,;1.43,-5.44,;2.2,-4.1,;-.11,-5.44,;4.51,-8.1,;6.05,-8.1,)\|
BDBM50020065	CCC1CN(C(=O)Nc2ccccc2)c2ccc(cc2O1)-c1cnc(OCC(C)(C)C(O)=O)nc1
BDBM50020066	C[C@H]1CN(C(=O)Nc2ccccc2)c2ccc(cc2O1)-c1ccc(cc1)[C@H]1CC[C@H](CC(O)=O)CC1 \|r,wU:26.29,wD:29.33,1.0,(3.83,-10.05,;5.18,-10.79,;5.22,-12.33,;6.57,-13.07,;6.61,-14.61,;7.95,-15.34,;5.29,-15.41,;5.33,-16.94,;4.01,-17.74,;4.05,-19.28,;5.4,-20.01,;6.71,-19.21,;6.68,-17.68,;7.88,-12.27,;9.23,-13.01,;10.55,-12.21,;10.51,-10.67,;9.16,-9.93,;7.85,-10.73,;6.5,-9.99,;11.83,-9.87,;11.79,-8.33,;13.1,-7.53,;14.45,-8.27,;14.49,-9.81,;13.18,-10.61,;15.77,-7.47,;15.73,-5.93,;17.04,-5.13,;18.39,-5.87,;19.71,-5.07,;19.67,-3.53,;20.99,-2.73,;18.32,-2.79,;18.43,-7.41,;17.12,-8.21,)\|
BDBM50020067	CCC1CN(C(=O)Nc2ccccc2)c2ccc(cc2O1)-c1ccc(OCC2(CC2)C(O)=O)nc1
BDBM50020068	OC(=O)C[C@H]1CC[C@@H](CC1)c1ccc(cc1)-c1ccc2N(CCOc2n1)C(=O)Nc1ccccc1 \|r,wU:7.10,wD:4.3,(22.48,-9.66,;20.94,-9.66,;20.17,-10.99,;20.17,-8.32,;18.63,-8.32,;17.86,-6.99,;16.32,-6.99,;15.55,-8.32,;16.32,-9.66,;17.86,-9.66,;14.01,-8.32,;13.24,-9.66,;11.7,-9.66,;10.93,-8.32,;11.7,-6.99,;13.24,-6.99,;9.39,-8.32,;8.62,-6.99,;7.08,-6.99,;6.31,-8.32,;4.77,-8.32,;4,-9.66,;4.77,-10.99,;6.31,-10.99,;7.08,-9.66,;8.62,-9.66,;4,-6.99,;4.77,-5.65,;2.46,-6.99,;1.69,-5.65,;.15,-5.65,;-.62,-4.32,;.15,-2.99,;1.69,-2.99,;2.46,-4.32,)\|
BDBM50020069	OC(=O)C[C@H]1CC[C@@H](CC1)c1ccc(cc1)-c1ccc2N(CCOc2c1)C(=O)Cc1ccccc1 \|r,wU:7.10,wD:4.3,(22.61,-2.81,;21.3,-3.62,;21.35,-5.16,;19.94,-2.9,;18.64,-3.71,;17.28,-2.99,;15.97,-3.81,;16.02,-5.34,;17.38,-6.07,;18.69,-5.25,;14.72,-6.16,;13.35,-5.43,;12.05,-6.24,;12.1,-7.78,;13.46,-8.51,;14.76,-7.7,;10.79,-8.6,;10.85,-10.14,;9.54,-10.95,;8.18,-10.23,;6.86,-11.05,;5.5,-10.31,;5.46,-8.76,;6.78,-7.95,;8.13,-8.69,;9.44,-7.87,;6.91,-12.58,;8.26,-13.31,;5.6,-13.39,;5.65,-14.92,;4.34,-15.71,;4.39,-17.25,;5.74,-17.98,;7.05,-17.16,;6.99,-15.63,)\|
BDBM50020070	OC(=O)C[C@H]1CC[C@@H](CC1)c1ccc(cc1)-c1ccc2N(CCOc2c1)C(=O)NCc1ccccc1 \|r,wU:7.10,wD:4.3,(20.88,.99,;19.56,.19,;18.21,.93,;19.6,-1.36,;18.29,-2.16,;16.93,-1.42,;15.62,-2.22,;15.66,-3.76,;17.01,-4.5,;18.32,-3.7,;14.34,-4.56,;12.99,-3.82,;11.68,-4.62,;11.71,-6.16,;13.06,-6.9,;14.38,-6.1,;10.4,-6.96,;10.44,-8.5,;9.12,-9.3,;7.77,-8.56,;6.46,-9.36,;5.1,-8.62,;5.07,-7.08,;6.38,-6.28,;7.73,-7.02,;9.05,-6.22,;6.49,-10.9,;7.84,-11.63,;5.18,-11.7,;5.21,-13.23,;3.9,-14.03,;2.55,-13.29,;1.24,-14.09,;1.28,-15.63,;2.63,-16.36,;3.94,-15.56,)\|
BDBM50020071	OC(=O)[C@@H]1CCC[C@H]1C(=O)c1ccc(cc1)-c1ccc2N(CCOc2c1)C(=O)Nc1ccccc1 \|r\|
BDBM50020072	CC1COc2cc(ccc2N1C(=O)Nc1ccccc1)-c1ccc(cc1)[C@H]1CC[C@H](CC(O)=O)CC1 \|r,wU:26.29,wD:29.33,(.8,-5.69,;2.34,-5.69,;3.11,-7.02,;4.65,-7.02,;5.42,-5.69,;6.96,-5.69,;7.73,-4.36,;6.96,-3.02,;5.42,-3.02,;4.65,-4.36,;3.11,-4.36,;2.34,-3.02,;3.11,-1.69,;.8,-3.02,;.03,-1.69,;-1.51,-1.69,;-2.28,-.35,;-1.51,.98,;.03,.98,;.8,-.35,;9.27,-4.36,;10.04,-5.69,;11.58,-5.69,;12.35,-4.36,;11.58,-3.02,;10.04,-3.02,;13.89,-4.36,;14.66,-3.02,;16.2,-3.02,;16.97,-4.36,;18.51,-4.36,;19.28,-5.69,;18.51,-7.02,;20.82,-5.69,;16.2,-5.69,;14.66,-5.69,)\|
BDBM50020073	OC(=O)C[C@H]1CC[C@@H](CC1)c1ccc(cc1)-c1ccc2N(CCOc2c1)C(=O)Nc1cc(ccc1F)C(F)(F)F \|r,wU:4.3,wD:7.10,(1.78,-14.15,;3.12,-13.38,;3.12,-11.84,;4.45,-14.15,;5.78,-13.38,;5.78,-11.84,;7.12,-11.07,;8.45,-11.84,;8.45,-13.38,;7.12,-14.15,;9.79,-11.07,;9.79,-9.53,;11.12,-8.76,;12.45,-9.53,;12.45,-11.07,;11.12,-11.84,;13.79,-8.76,;15.12,-9.53,;16.45,-8.76,;16.45,-7.22,;17.79,-6.45,;17.79,-4.91,;16.45,-4.14,;15.12,-4.91,;15.12,-6.45,;13.79,-7.22,;19.12,-7.22,;19.12,-8.76,;20.46,-6.45,;21.79,-7.22,;21.79,-8.76,;23.12,-9.53,;24.46,-8.76,;24.46,-7.22,;23.12,-6.45,;23.12,-4.91,;23.12,-11.07,;21.85,-11.97,;24.3,-11.88,;23.12,-12.61,)\|
BDBM50020074	CS(=O)(=O)NC(=O)C[C@H]1CC[C@@H](CC1)c1ccc(cc1)-c1ccc2N(CCOc2c1)C(=O)Nc1ccccc1 \|r,wU:11.14,wD:8.7,(24.03,-4.14,;22.72,-4.94,;21.23,-5.33,;21.63,-3.84,;22.76,-6.48,;21.44,-7.28,;20.09,-6.54,;21.48,-8.82,;20.17,-9.62,;18.81,-8.88,;17.5,-9.67,;17.54,-11.21,;18.89,-11.95,;20.2,-11.15,;16.22,-12.01,;14.87,-11.27,;13.56,-12.07,;13.6,-13.61,;14.95,-14.35,;16.26,-13.55,;12.28,-14.41,;12.32,-15.95,;11.01,-16.75,;9.65,-16.01,;8.34,-16.81,;6.99,-16.07,;6.95,-14.53,;8.27,-13.73,;9.62,-14.47,;10.93,-13.67,;8.38,-18.35,;9.72,-19.08,;7.06,-19.15,;7.1,-20.69,;5.78,-21.48,;5.82,-23.02,;7.17,-23.76,;8.49,-22.95,;8.45,-21.42,)\|
BDBM50020075	N[C@H](C(=O)N1CCOc2cc(ccc12)-c1ccc(cc1)[C@H]1CC[C@H](CC(O)=O)CC1)c1ccccc1 \|r,wU:20.22,1.0,wD:23.26,(6.93,-14.91,;6.88,-13.38,;8.19,-12.57,;9.54,-13.3,;8.14,-11.04,;6.78,-10.3,;6.74,-8.75,;8.06,-7.95,;9.41,-8.68,;10.72,-7.86,;12.07,-8.59,;12.13,-10.13,;10.82,-10.94,;9.45,-10.23,;13.38,-7.78,;13.33,-6.24,;14.63,-5.43,;15.99,-6.15,;16.04,-7.69,;14.74,-8.5,;17.3,-5.33,;17.25,-3.8,;18.55,-2.98,;19.91,-3.7,;21.22,-2.89,;22.58,-3.62,;23.88,-2.8,;22.63,-5.15,;19.96,-5.25,;18.65,-6.06,;5.53,-12.65,;5.5,-11.12,;4.15,-10.39,;2.84,-11.2,;2.89,-12.74,;4.24,-13.46,)\|
BDBM50020076	Nc1ccccc1NC(=O)N1CCOc2cc(ccc12)-c1ccc(cc1)[C@H]1CC[C@H](CC(O)=O)CC1 \|r,wU:29.33,wD:26.29,(2.65,-29.35,;3.42,-28.02,;2.65,-26.68,;3.42,-25.35,;4.96,-25.35,;5.73,-26.68,;4.96,-28.02,;5.73,-29.35,;7.27,-29.35,;8.04,-28.02,;8.04,-30.68,;7.27,-32.02,;8.04,-33.35,;9.58,-33.35,;10.35,-32.02,;11.89,-32.02,;12.66,-30.68,;11.89,-29.35,;10.35,-29.35,;9.58,-30.68,;14.2,-30.68,;14.97,-32.02,;16.51,-32.02,;17.28,-30.68,;16.51,-29.35,;14.97,-29.35,;18.82,-30.68,;19.59,-32.02,;21.13,-32.02,;21.9,-30.68,;23.44,-30.68,;24.21,-32.02,;23.44,-33.35,;25.75,-32.02,;21.13,-29.35,;19.59,-29.35,)\|
BDBM50020077	OC(=O)[C@@H]1CCC[C@H]1C(=O)c1ccc(cc1)-c1ccc2n(ccc2c1)C(=O)Nc1ccccc1 \|r\|
BDBM50020078	OC(=O)C[C@H]1CC[C@@H](CC1)c1ccc(cc1)-c1cccc2N(CCOc12)C(=O)Nc1ccccc1 \|r,wU:7.10,wD:4.3,(19.28,3.4,;17.95,2.63,;16.62,3.4,;17.95,1.09,;16.62,.32,;15.28,1.09,;13.95,.32,;13.95,-1.22,;15.28,-1.99,;16.62,-1.22,;12.62,-1.99,;12.62,-3.53,;11.28,-4.3,;9.95,-3.53,;9.95,-1.99,;11.28,-1.22,;8.62,-4.3,;7.28,-3.53,;5.95,-4.3,;5.95,-5.84,;7.28,-6.61,;7.28,-8.15,;8.62,-8.92,;9.95,-8.15,;9.95,-6.61,;8.62,-5.84,;5.95,-8.92,;4.61,-8.15,;5.95,-10.46,;4.61,-11.23,;4.61,-12.77,;3.28,-13.54,;1.95,-12.77,;1.95,-11.23,;3.28,-10.46,)\|
BDBM50020079	OC(=O)C[C@H]1CC[C@@H](CC1)c1ccc(cc1)-c1ccc2OCCN(C(=O)Nc3ccccc3)c2c1 \|r,wU:7.10,wD:4.3,(28.28,-.1,;26.95,-.87,;26.95,-2.41,;25.61,-.1,;24.28,-.87,;22.95,-.1,;21.61,-.87,;21.61,-2.41,;22.95,-3.18,;24.28,-2.41,;20.28,-3.18,;20.28,-4.72,;18.94,-5.49,;17.61,-4.72,;17.61,-3.18,;18.94,-2.41,;16.28,-5.49,;16.28,-7.03,;14.94,-7.8,;13.61,-7.03,;12.28,-7.8,;10.94,-7.03,;10.94,-5.49,;12.28,-4.72,;12.28,-3.18,;13.61,-2.41,;10.94,-2.41,;10.94,-.87,;9.61,-.1,;9.61,1.44,;10.94,2.21,;12.28,1.44,;12.28,-.1,;13.61,-5.49,;14.94,-4.72,)\|
BDBM50020080	OC(=O)C[C@H]1CC[C@@H](CC1)c1ccc(cc1)-c1cnc2N(CCOc2c1)C(=O)Nc1ccccc1 \|r,wU:7.10,wD:4.3,(24.29,-5.34,;22.75,-5.34,;21.98,-6.68,;21.98,-4.01,;20.44,-4.01,;19.67,-2.68,;18.13,-2.68,;17.36,-4.01,;18.13,-5.34,;19.67,-5.34,;15.82,-4.01,;15.05,-5.34,;13.51,-5.34,;12.74,-4.01,;13.51,-2.68,;15.05,-2.68,;11.2,-4.01,;10.43,-2.68,;8.89,-2.68,;8.12,-4.01,;6.58,-4.01,;5.81,-5.34,;6.58,-6.68,;8.12,-6.68,;8.89,-5.34,;10.43,-5.34,;5.81,-2.68,;6.58,-1.34,;4.27,-2.68,;3.5,-1.34,;1.96,-1.34,;1.19,-.01,;1.96,1.33,;3.5,1.33,;4.27,-.01,)\|
BDBM50020081	CC1Oc2cc(ccc2N(C(=O)Nc2ccccc2)C1=O)-c1ccc(cc1)[C@H]1CC[C@H](CC(O)=O)CC1 \|r,wU:27.30,wD:30.34,(3,-8.79,;3.77,-7.46,;5.31,-7.46,;6.08,-6.13,;7.62,-6.13,;8.39,-4.79,;7.62,-3.46,;6.08,-3.46,;5.31,-4.79,;3.77,-4.79,;3,-3.46,;3.77,-2.13,;1.46,-3.46,;.69,-2.13,;-.85,-2.13,;-1.62,-.79,;-.85,.54,;.69,.54,;1.46,-.79,;3,-6.13,;1.46,-6.13,;9.93,-4.79,;10.7,-6.13,;12.24,-6.13,;13.01,-4.79,;12.24,-3.46,;10.7,-3.46,;14.55,-4.79,;15.32,-3.46,;16.86,-3.46,;17.63,-4.79,;19.17,-4.79,;19.94,-6.13,;21.48,-6.13,;19.17,-7.46,;16.86,-6.13,;15.32,-6.13,)\|
BDBM50020082	OC(=O)C[C@H]1CC[C@@H](CC1)c1ccc(cc1)-c1ccc2N(CCOc2c1)S(=O)(=O)Cc1ccccc1 \|r,wU:7.10,wD:4.3,(29.7,-15.27,;31.04,-16.03,;32.36,-15.24,;31.06,-17.57,;29.73,-18.35,;28.39,-17.59,;27.07,-18.38,;27.09,-19.92,;28.43,-20.67,;29.75,-19.89,;25.76,-20.7,;24.42,-19.94,;23.1,-20.73,;23.12,-22.27,;24.46,-23.02,;25.78,-22.24,;21.79,-23.05,;21.81,-24.59,;20.49,-25.37,;19.15,-24.62,;17.82,-25.4,;16.48,-24.64,;16.47,-23.1,;17.79,-22.32,;19.13,-23.07,;20.45,-22.29,;17.84,-26.93,;16.35,-26.52,;17.44,-28.4,;19.16,-27.72,;19.12,-29.26,;17.78,-30,;17.75,-31.54,;19.06,-32.34,;20.4,-31.6,;20.44,-30.06,)\|
BDBM50020083	OC(=O)C[C@H]1CC[C@@H](CC1)c1ccc(cc1)-c1ccc2N(CCOc2c1)c1nc2ccccc2o1 \|r,wU:4.3,wD:7.10,(3.07,-6.86,;4.61,-6.86,;5.38,-5.53,;5.38,-8.2,;6.92,-8.2,;7.69,-6.86,;9.23,-6.86,;10,-8.2,;9.23,-9.53,;7.69,-9.53,;11.54,-8.2,;12.31,-6.86,;13.85,-6.86,;14.62,-8.2,;13.85,-9.53,;12.31,-9.53,;16.16,-8.2,;16.93,-9.53,;18.47,-9.53,;19.24,-8.2,;20.78,-8.2,;21.55,-6.86,;20.78,-5.53,;19.24,-5.53,;18.47,-6.86,;16.93,-6.86,;21.55,-9.53,;20.92,-10.94,;22.07,-11.97,;22.07,-13.51,;23.4,-14.28,;24.73,-13.51,;24.73,-11.97,;23.4,-11.2,;23.08,-9.69,)\|
BDBM50020084	OC(=O)C[C@H]1CC[C@@H](CC1)c1ccc(cc1)-c1ccc2N(CCOc2c1)C(=O)Nc1ccccc1C(O)=O \|r,wU:7.10,wD:4.3,(24.43,-3.81,;23.11,-4.61,;21.76,-3.87,;23.15,-6.15,;21.84,-6.95,;20.48,-6.21,;19.17,-7.01,;19.21,-8.55,;20.56,-9.29,;21.87,-8.49,;17.89,-9.35,;16.54,-8.61,;15.23,-9.41,;15.27,-10.95,;16.62,-11.69,;17.93,-10.89,;13.95,-11.75,;13.99,-13.29,;12.68,-14.09,;11.32,-13.35,;10.01,-14.15,;8.66,-13.41,;8.62,-11.87,;9.94,-11.07,;11.29,-11.81,;12.6,-11.01,;10.05,-15.69,;11.39,-16.42,;8.73,-16.49,;8.77,-18.02,;10.12,-18.76,;10.15,-20.29,;8.84,-21.09,;7.49,-20.36,;7.45,-18.82,;6.1,-18.08,;6.06,-16.54,;4.78,-18.88,)\|
BDBM50020085	CC(C)c1ccccc1NC(=O)N1CCOc2cc(ccc12)-c1ccc(cc1)[C@H]1CC[C@H](CC(O)=O)CC1 \|r,wU:28.31,wD:31.35,(4.62,-16.39,;4.66,-17.93,;3.34,-18.73,;6.01,-18.67,;6.04,-20.21,;7.39,-20.95,;8.71,-20.15,;8.68,-18.61,;7.32,-17.87,;7.29,-16.34,;8.61,-15.53,;9.95,-16.27,;8.57,-13.99,;7.22,-13.25,;7.18,-11.71,;8.5,-10.91,;9.85,-11.65,;11.16,-10.85,;12.52,-11.59,;12.55,-13.13,;11.24,-13.93,;9.88,-13.19,;13.83,-10.79,;13.79,-9.25,;15.11,-8.45,;16.46,-9.19,;16.5,-10.73,;15.18,-11.53,;17.78,-8.39,;17.74,-6.85,;19.06,-6.05,;20.41,-6.79,;21.72,-5.99,;21.69,-4.45,;23,-3.65,;20.33,-3.7,;20.44,-8.33,;19.13,-9.13,)\|
BDBM140511	OC(=O)CC1CCC(CC1)c1ccc(cc1)-c1cnc(Nc2ccc(cc2Cl)C(F)(F)F)o1 \|(2.47,10.67,;2.47,9.13,;1.13,8.36,;3.8,8.36,;3.8,6.82,;5.14,6.05,;5.14,4.51,;3.8,3.74,;2.47,4.51,;2.47,6.05,;3.8,2.2,;5.14,1.43,;5.14,-.11,;3.8,-.88,;2.47,-.11,;2.47,1.43,;3.8,-2.42,;2.56,-3.33,;3.03,-4.79,;4.57,-4.79,;5.48,-6.04,;4.85,-7.45,;3.32,-7.61,;2.69,-9.02,;3.6,-10.26,;5.13,-10.1,;5.76,-8.69,;7.29,-8.53,;2.97,-11.67,;2.35,-13.08,;1.56,-11.04,;4.38,-12.29,;5.05,-3.33,)\|
BDBM140512	OC(=O)CCc1ccc(cc1)-c1ccc(cc1)-c1cnc(Nc2cccc(Cl)c2)o1
BDBM140513	OC(=O)CCC(=O)N1CCC(=CC1)c1ccc(cc1)-c1cnc(Nc2cccc(Cl)c2)o1 \|c:10\|
BDBM140514	OC(=O)CCNC(=O)c1ccc(cc1)-c1ccc(Nc2cccc(Cl)c2)nn1
BDBM50031506	OC(=O)[C@@H]1CC[C@@H](CC1)OC1CCN(CC1)c1ccc(cn1)-c1nc2cc(Cl)ccc2[nH]1 \|r,wU:6.9,3.2,(22.66,-7.8,;22.66,-6.26,;24,-5.5,;21.33,-5.48,;21.33,-3.94,;20,-3.16,;18.67,-3.93,;18.66,-5.48,;19.99,-6.25,;17.33,-3.16,;16,-3.93,;16,-5.47,;14.67,-6.24,;13.34,-5.47,;13.33,-3.93,;14.66,-3.16,;12,-6.24,;10.67,-5.47,;9.34,-6.25,;9.34,-7.79,;10.67,-8.56,;12.01,-7.79,;8,-8.55,;6.6,-7.93,;5.57,-9.07,;4.04,-9.07,;3.27,-10.4,;1.73,-10.4,;4.04,-11.73,;5.57,-11.73,;6.33,-10.4,;7.84,-10.08,)\|
BDBM50031502	OC(=O)[C@@H]1CC[C@@H](CC1)OC1CCN(CC1)c1ccc(cn1)-c1nc2cc(ccc2[nH]1)C(F)(F)F \|r,wU:6.9,3.2,(22.37,-7.8,;22.37,-6.26,;23.71,-5.5,;21.04,-5.48,;21.04,-3.94,;19.71,-3.16,;18.38,-3.93,;18.37,-5.48,;19.7,-6.25,;17.05,-3.16,;15.71,-3.93,;15.71,-5.47,;14.38,-6.24,;13.05,-5.47,;13.04,-3.93,;14.38,-3.16,;11.71,-6.24,;10.38,-5.47,;9.05,-6.25,;9.05,-7.79,;10.38,-8.56,;11.72,-7.79,;7.71,-8.55,;6.31,-7.93,;5.28,-9.07,;3.75,-9.07,;2.98,-10.4,;3.76,-11.73,;5.28,-11.73,;6.05,-10.4,;7.55,-10.08,;1.44,-10.4,;.67,-9.07,;.67,-11.74,;-.1,-10.4,)\|
BDBM50031503	OC(=O)[C@H]1CC[C@@H](CC1)OC1CCN(CC1)c1ccc(cn1)-c1nc2cc(ccc2[nH]1)C(F)(F)F \|r,wU:6.9,wD:3.2,(29.05,-9.85,;29.05,-8.31,;30.39,-7.55,;27.72,-7.54,;27.72,-6,;26.39,-5.22,;25.06,-5.98,;25.06,-7.53,;26.38,-8.3,;23.73,-5.21,;22.39,-5.98,;22.39,-7.52,;21.07,-8.29,;19.73,-7.52,;19.72,-5.98,;21.06,-5.21,;18.4,-8.29,;17.06,-7.53,;15.73,-8.3,;15.73,-9.84,;17.06,-10.61,;18.4,-9.84,;14.4,-10.61,;12.99,-9.98,;11.96,-11.13,;10.43,-11.13,;9.66,-12.46,;10.44,-13.79,;11.97,-13.78,;12.73,-12.46,;14.23,-12.14,;8.12,-12.46,;7.35,-11.13,;7.35,-13.79,;6.58,-12.45,)\|
BDBM50031504	OC(=O)[C@@H]1CC[C@@H](CC1)OC1CCN(CC1)c1ccc(cn1)-c1nc2cc(F)ccc2[nH]1 \|r,wU:6.9,3.2,(22.66,-7.8,;22.66,-6.26,;24,-5.5,;21.33,-5.48,;21.33,-3.94,;20,-3.16,;18.67,-3.93,;18.66,-5.48,;19.99,-6.25,;17.33,-3.16,;16,-3.93,;16,-5.47,;14.67,-6.24,;13.34,-5.47,;13.33,-3.93,;14.66,-3.16,;12,-6.24,;10.67,-5.47,;9.34,-6.25,;9.34,-7.79,;10.67,-8.56,;12.01,-7.79,;8,-8.55,;6.6,-7.93,;5.57,-9.07,;4.04,-9.07,;3.27,-10.4,;1.73,-10.4,;4.04,-11.73,;5.57,-11.73,;6.33,-10.4,;7.84,-10.08,)\|
BDBM50031505	OC(=O)[C@H]1CC[C@@H](CC1)OC1CCN(CC1)c1ccc(cn1)-c1nc2cc(F)ccc2[nH]1 \|r,wU:6.9,wD:3.2,(37.68,-12.65,;37.68,-11.11,;39.02,-10.34,;36.35,-10.33,;36.35,-8.79,;35.02,-8.01,;33.69,-8.77,;33.68,-10.32,;35.01,-11.09,;32.35,-8,;31.02,-8.77,;31.02,-10.31,;29.69,-11.08,;28.36,-10.31,;28.35,-8.78,;29.68,-8,;27.02,-11.08,;25.69,-10.32,;24.36,-11.09,;24.36,-12.64,;25.69,-13.41,;27.03,-12.63,;23.02,-13.4,;21.62,-12.77,;20.59,-13.92,;19.05,-13.92,;18.29,-15.25,;16.75,-15.25,;19.06,-16.58,;20.59,-16.57,;21.35,-15.25,;22.86,-14.93,)\|
BDBM50090510	CC(=O)Nc1cc(cc2CCN(CCc3ccccc3)c12)S(=O)(=O)Nc1ccc(F)cc1F
BDBM50031501	OC(=O)[C@H]1CC[C@@H](CC1)OC1CCN(CC1)c1ccc(cn1)-c1nc2cc(Cl)ccc2[nH]1 \|r,wU:6.9,wD:3.2,(37.68,-12.65,;37.68,-11.11,;39.02,-10.34,;36.35,-10.33,;36.35,-8.79,;35.02,-8.01,;33.69,-8.77,;33.68,-10.32,;35.01,-11.09,;32.35,-8,;31.02,-8.77,;31.02,-10.31,;29.69,-11.08,;28.36,-10.31,;28.35,-8.78,;29.68,-8,;27.02,-11.08,;25.69,-10.32,;24.36,-11.09,;24.36,-12.64,;25.69,-13.41,;27.03,-12.63,;23.02,-13.4,;21.62,-12.77,;20.59,-13.92,;19.05,-13.92,;18.29,-15.25,;16.75,-15.25,;19.06,-16.58,;20.59,-16.57,;21.35,-15.25,;22.86,-14.93,)\|
BDBM220886	CC(C)(COc1ccc(cc1)-c1ccc(cn1)-c1nc(c[nH]1)C(F)(F)F)C(O)=O
BDBM50117145	OC(=O)C12CC3CC(C1)C(Oc1ccc(cc1)C(=O)NCCNS(=O)(=O)c1ccccc1)C(C3)C2 \|TLB:6:5:34:8.7.9,6:7:4.5.33:34,THB:10:9:4.5.33:34,9:7:4:33.32.34,9:32:4:8.6.7,(3.79,.17,;3.07,1.17,;3.58,2.29,;1.56,1.02,;1.56,2.59,;.12,3.07,;-1.2,2.69,;-1.2,1.02,;.34,.44,;-2.19,-.22,;-3.39,-1.16,;-3.17,-2.69,;-4.38,-3.64,;-4.16,-5.17,;-2.73,-5.74,;-1.52,-4.78,;-1.74,-3.26,;-2.5,-7.26,;-3.47,-8.03,;-1.07,-7.83,;-.85,-9.36,;.59,-9.92,;.81,-11.45,;2.24,-12.02,;3.21,-11.25,;2.06,-10.8,;2.47,-13.54,;1.26,-14.5,;1.48,-16.02,;2.92,-16.59,;4.12,-15.63,;3.9,-14.11,;-.95,.32,;-1,2.05,;.56,-.22,)\|
BDBM50117146	OC(=O)C12CC3CC(C1)C(Oc1ccc(cc1)C(=O)NCCNC(=O)Nc1ccccc1)C(C3)C2 \|TLB:6:5:34:8.7.9,6:7:4.5.33:34,THB:9:7:4:33.32.34,9:32:4:8.6.7,10:9:4.5.33:34,(3.79,.17,;3.07,1.17,;3.58,2.29,;1.56,1.02,;1.56,2.59,;.12,3.07,;-1.2,2.69,;-1.2,1.02,;.34,.44,;-2.19,-.22,;-3.39,-1.16,;-3.17,-2.69,;-4.38,-3.64,;-4.16,-5.17,;-2.73,-5.74,;-1.52,-4.78,;-1.74,-3.26,;-2.5,-7.26,;-3.47,-8.03,;-1.07,-7.83,;-.85,-9.36,;.59,-9.92,;.81,-11.45,;2.24,-12.02,;3.21,-11.25,;2.47,-13.54,;3.9,-14.11,;4.13,-15.63,;5.56,-16.2,;6.76,-15.24,;6.54,-13.72,;5.1,-13.15,;-.95,.32,;-1,2.05,;.56,-.22,)\|
BDBM50117147	NCCNC(=O)c1ccc(OC2C3CC4CC2CC(C4)(C3)C(O)=O)cc1 \|TLB:11:12:19:15.16.17,10:11:19.14.15:17,THB:13:14:17:20.12.11,13:12:19.14.15:17,11:16:19:20.13.12,(.77,-11.14,;.59,-9.92,;-.85,-9.36,;-1.07,-7.83,;-2.5,-7.26,;-3.47,-8.03,;-2.73,-5.74,;-4.16,-5.17,;-4.38,-3.64,;-3.17,-2.69,;-3.39,-1.16,;-2.19,-.22,;-1.2,1.02,;-1.2,2.69,;.12,3.07,;-1,2.05,;-.95,.32,;.56,-.22,;1.56,1.02,;1.56,2.59,;.34,.44,;3.07,1.17,;3.79,.17,;3.58,2.29,;-1.74,-3.26,;-1.52,-4.78,)\|
BDBM50117149	OC(=O)[C@@]12CC3CC(C1)[C@H](Oc1ccc(cc1)C(=O)NCCNC(=O)c1ccc(cc1)-c1ccccc1)C(C3)C2 \|r,wU:9.10,wD:3.2,TLB:6:5:39:8.7.9,6:7:4.5.38:39,THB:9:7:4:38.37.39,9:37:4:8.6.7,10:9:4.5.38:39,(3.59,2.27,;3.07,1.15,;3.78,.15,;1.56,1.02,;1.56,2.59,;.12,3.07,;-1.2,2.69,;-1.2,1.02,;.34,.44,;-2.19,-.22,;-3.39,-1.17,;-4.82,-.59,;-6.03,-1.54,;-7.46,-.97,;-7.68,.56,;-6.46,1.51,;-5.03,.93,;-9.1,1.13,;-10.07,.37,;-9.32,2.66,;-10.75,3.24,;-10.96,4.76,;-12.39,5.34,;-12.61,6.87,;-11.63,7.62,;-14.03,7.44,;-14.25,8.97,;-15.68,9.54,;-16.89,8.59,;-16.67,7.07,;-15.25,6.49,;-18.32,9.17,;-18.54,10.69,;-19.97,11.26,;-21.18,10.31,;-20.96,8.79,;-19.53,8.21,;-.95,.32,;-1,2.05,;.56,-.22,)\|
BDBM50117150	Cc1cccc(C)c1-c1ccc(cc1)C(=O)NCCNC(=O)c1ccc(O[C@H]2C3CC4CC2C[C@](C4)(C3)C(O)=O)cc1 \|r,wU:27.28,wD:34.41,TLB:27:28:35:31.32.33,26:27:35.30.31:33,THB:29:30:33:36.28.27,29:28:35.30.31:33,27:32:35:36.29.28,(-19.36,6.99,;-19.53,8.21,;-20.96,8.79,;-21.18,10.31,;-19.97,11.26,;-18.54,10.69,;-17.57,11.45,;-18.32,9.17,;-16.89,8.59,;-15.68,9.54,;-14.25,8.97,;-14.03,7.44,;-15.25,6.49,;-16.67,7.07,;-12.61,6.87,;-11.63,7.62,;-12.39,5.34,;-10.96,4.76,;-10.75,3.24,;-9.32,2.66,;-9.1,1.13,;-10.07,.37,;-7.68,.56,;-7.46,-.97,;-6.03,-1.54,;-4.82,-.59,;-3.39,-1.17,;-2.19,-.22,;-1.2,1.02,;-1.2,2.69,;.12,3.07,;-1,2.05,;-.95,.32,;.56,-.22,;1.56,1.02,;1.56,2.59,;.34,.44,;3.07,1.15,;3.59,2.27,;3.78,.15,;-5.03,.93,;-6.46,1.51,)\|
BDBM50117152	OC(=O)[C@]12CC3CC(C1)[C@H](Oc1ccc(cc1)C(=O)NCCNC(=O)c1ccc(cc1)-c1ccccc1)C(C3)C2 \|r,wD:9.10,3.2,TLB:38:37:4.5.6:8,THB:38:5:8:39.37.9,9:37:4:6.7.8,9:7:4:39.38.37,10:9:4.5.6:8,(3.59,2.27,;3.07,1.15,;3.78,.15,;1.56,1.02,;1.56,2.59,;.12,3.07,;-1,2.05,;-.95,.32,;.56,-.22,;-2.19,-.22,;-3.39,-1.17,;-4.82,-.59,;-6.03,-1.54,;-7.46,-.97,;-7.68,.56,;-6.46,1.51,;-5.03,.93,;-9.1,1.13,;-10.07,.37,;-9.32,2.66,;-10.75,3.24,;-10.96,4.76,;-12.39,5.34,;-12.61,6.87,;-11.63,7.62,;-14.03,7.44,;-14.25,8.97,;-15.68,9.54,;-16.89,8.59,;-16.67,7.07,;-15.25,6.49,;-18.32,9.17,;-18.54,10.69,;-19.97,11.26,;-21.18,10.31,;-20.96,8.79,;-19.53,8.21,;-1.2,1.02,;-1.2,2.69,;.34,.44,)\|
BDBM50117184	OC(=O)[C@@]12CC3CC(C1)[C@H](Oc1ccc(cc1)C(=O)NCCNC(=O)c1ccc4ccccc4c1)C(C3)C2 \|r,wU:3.2,wD:9.10,TLB:8:3:6.7.9:36,10:9:4.37.3:36,THB:1:3:6.7.9:36,8:7:4.37.3:36,9:7:4:37.36.35,9:35:4:6.7.8,(3.58,2.29,;3.07,1.17,;3.79,.17,;1.56,1.02,;1.56,2.59,;.12,3.07,;-1,2.05,;-.95,.32,;.56,-.22,;-2.19,-.22,;-3.39,-1.17,;-4.82,-.59,;-6.03,-1.54,;-7.46,-.97,;-7.68,.56,;-6.46,1.51,;-5.03,.93,;-9.11,1.13,;-9.28,2.35,;-10.32,.17,;-11.75,.75,;-12.96,-.21,;-14.39,.37,;-15.6,-.59,;-15.43,-1.81,;-17.03,-.02,;-17.25,1.51,;-18.69,2.08,;-19.9,1.13,;-21.33,1.7,;-22.54,.75,;-22.32,-.77,;-20.89,-1.35,;-19.68,-.4,;-18.26,-.97,;-1.2,1.02,;-1.2,2.69,;.34,.44,)\|
BDBM50117185	OC(=O)CC1C2CC3CC1CC(C3)(C2)Oc1ccc(cc1)C(=O)NCCNC(=O)c1ccc(cc1)-c1ccccc1 \|TLB:3:4:6:13.12.11,14:11:6:8.9.4,THB:12:7:4:13.11.10,12:11:6.7.8:4,10:11:6:8.9.4,10:9:6:13.12.11,14:11:6.7.8:4,(-2.02,-3.15,;-3.17,-2.69,;-4.14,-3.45,;-3.39,-1.16,;-2.19,-.22,;-1.2,1.02,;-1.2,2.69,;.12,3.07,;-1,2.05,;-.95,.32,;.56,-.22,;1.56,1.02,;1.56,2.59,;.34,.44,;3.07,1.17,;3.97,-.08,;5.51,.07,;6.4,-1.18,;5.77,-2.58,;4.24,-2.73,;3.34,-1.48,;6.67,-3.83,;7.89,-3.71,;6.03,-5.24,;6.93,-6.49,;6.29,-7.89,;7.19,-9.15,;6.55,-10.55,;5.33,-10.67,;7.45,-11.8,;6.82,-13.21,;7.71,-14.46,;9.25,-14.3,;9.88,-12.9,;8.98,-11.65,;10.15,-15.56,;9.52,-16.96,;10.42,-18.21,;11.95,-18.05,;12.58,-16.65,;11.68,-15.4,)\|
BDBM50117186	OC(=O)C12CC3CC(C1)C(Oc1ccc(cc1)C(=O)NCCNC(=O)c1cn(nc1C(F)(F)F)-c1ccccc1)C(C3)C2 \|TLB:6:5:42:8.7.9,6:7:4.5.41:42,THB:9:7:4:41.40.42,9:40:4:8.6.7,10:9:4.5.41:42,(3.79,.17,;3.07,1.17,;3.58,2.29,;1.56,1.02,;1.56,2.59,;.12,3.07,;-1.2,2.69,;-1.2,1.02,;.34,.44,;-2.19,-.22,;-3.39,-1.16,;-3.17,-2.69,;-4.38,-3.64,;-4.16,-5.17,;-2.73,-5.74,;-1.52,-4.78,;-1.74,-3.26,;-2.5,-7.26,;-3.47,-8.03,;-1.07,-7.83,;-.85,-9.36,;.59,-9.92,;.81,-11.45,;2.24,-12.02,;3.21,-11.25,;2.47,-13.54,;1.36,-14.59,;2.04,-15.98,;3.57,-15.75,;3.83,-14.24,;5.2,-13.55,;5.27,-12.32,;6.23,-14.22,;6.3,-12.99,;1.32,-17.34,;2.04,-18.7,;1.23,-20,;-.31,-19.94,;-1.03,-18.58,;-.22,-17.28,;-.95,.32,;-1,2.05,;.56,-.22,)\|
BDBM220966	Cc1cc(OCC(C)(C)C(O)=O)ncc1-c1cnc(-c2ncc([nH]2)C(F)(F)F)c(C)c1
BDBM50117187	OC(=O)C12CC3CC(C1)C(Oc1ccc(cc1)C(=O)NCCNC(=O)c1nc(oc1C(F)(F)F)-c1ccccc1)C(C3)C2 \|TLB:6:5:42:8.7.9,6:7:4.5.41:42,THB:9:7:4:41.40.42,9:40:4:8.6.7,10:9:4.5.41:42,(3.79,.17,;3.07,1.17,;3.58,2.29,;1.56,1.02,;1.56,2.59,;.12,3.07,;-1.2,2.69,;-1.2,1.02,;.34,.44,;-2.19,-.22,;-3.39,-1.16,;-3.17,-2.69,;-4.38,-3.64,;-4.16,-5.17,;-2.73,-5.74,;-1.52,-4.78,;-1.74,-3.26,;-2.5,-7.26,;-3.47,-8.03,;-1.07,-7.83,;-.85,-9.36,;.59,-9.92,;.81,-11.45,;2.24,-12.02,;3.21,-11.25,;2.47,-13.54,;1.36,-14.59,;2.04,-15.98,;3.57,-15.75,;3.83,-14.24,;5.2,-13.55,;5.27,-12.32,;6.23,-14.22,;6.3,-12.99,;1.32,-17.34,;2.04,-18.7,;1.23,-20,;-.31,-19.94,;-1.03,-18.58,;-.22,-17.28,;-.95,.32,;-1,2.05,;.56,-.22,)\|
BDBM50117189	OC(=O)C12CC3CC(C1)C(Oc1ccc(cc1)C(=O)NCCNC(=O)c1ccc(cc1)-c1ccccc1)C(C3)C2 \|TLB:6:5:39:8.7.9,6:7:4.5.38:39,THB:9:7:4:38.37.39,9:37:4:8.6.7,10:9:4.5.38:39,(3.79,.17,;3.07,1.17,;3.58,2.29,;1.56,1.02,;1.56,2.59,;.12,3.07,;-1.2,2.69,;-1.2,1.02,;.34,.44,;-2.19,-.22,;-3.39,-1.16,;-3.17,-2.69,;-4.38,-3.64,;-4.16,-5.17,;-2.73,-5.74,;-1.52,-4.78,;-1.74,-3.26,;-2.5,-7.26,;-3.47,-8.03,;-1.07,-7.83,;-.85,-9.36,;.59,-9.92,;.81,-11.45,;2.24,-12.02,;3.21,-11.25,;2.47,-13.54,;3.9,-14.11,;4.12,-15.64,;2.91,-16.59,;1.48,-16.02,;1.26,-14.5,;3.13,-18.12,;4.56,-18.69,;4.78,-20.21,;3.57,-21.16,;2.14,-20.59,;1.92,-19.07,;-.95,.32,;-1,2.05,;.56,-.22,)\|
BDBM50117190	OC(=O)C12CC3CC(C1)C(Oc1ccc(cc1)C(=O)NCCNC(=O)c1ccc4ccccc4c1)C(C3)C2 \|TLB:6:5:37:8.7.9,6:7:4.5.36:37,THB:9:7:4:36.35.37,9:35:4:8.6.7,10:9:4.5.36:37,(3.79,.17,;3.07,1.17,;3.58,2.29,;1.56,1.02,;1.56,2.59,;.12,3.07,;-1.2,2.69,;-1.2,1.02,;.34,.44,;-2.19,-.22,;-3.39,-1.16,;-3.17,-2.69,;-4.38,-3.64,;-4.16,-5.17,;-2.73,-5.74,;-1.52,-4.78,;-1.74,-3.26,;-2.5,-7.26,;-3.47,-8.03,;-1.07,-7.83,;-.85,-9.36,;.59,-9.93,;.81,-11.45,;2.24,-12.02,;3.21,-11.25,;2.47,-13.54,;3.9,-14.11,;4.11,-15.65,;2.9,-16.6,;3.12,-18.12,;1.91,-19.07,;.48,-18.5,;.26,-16.98,;1.47,-16.03,;1.25,-14.51,;-.95,.32,;-1,2.05,;.56,-.22,)\|
BDBM50117191	OC(=O)C12CC3CC(C1)C(Oc1ccc(cc1)C(=O)NCCNC(=O)c1ccccc1)C(C3)C2 \|TLB:6:5:33:8.7.9,6:7:4.5.32:33,THB:9:7:4:32.31.33,9:31:4:8.6.7,10:9:4.5.32:33,(3.79,.17,;3.07,1.17,;3.58,2.29,;1.56,1.02,;1.56,2.59,;.12,3.07,;-1.2,2.69,;-1.2,1.02,;.34,.44,;-2.19,-.22,;-3.39,-1.16,;-3.17,-2.69,;-4.38,-3.64,;-4.16,-5.17,;-2.73,-5.74,;-1.52,-4.78,;-1.74,-3.26,;-2.5,-7.26,;-3.47,-8.03,;-1.07,-7.83,;-.85,-9.36,;.59,-9.92,;.81,-11.45,;2.24,-12.02,;3.21,-11.25,;2.47,-13.54,;3.9,-14.11,;4.12,-15.64,;2.91,-16.59,;1.48,-16.02,;1.26,-14.5,;-.95,.32,;-1,2.05,;.56,-.22,)\|
BDBM50117659	COc1cccc(CC(=O)N2Cc3ccc(cc3C2)S(=O)(=O)NCCc2cccc(F)c2)c1
BDBM50117192	OC(=O)[C@@]12CC3CC(C1)[C@H](Oc1ccc(cc1)C(=O)NCCNC(=O)c1ccc(cc1)-c1c(F)cccc1F)C(C3)C2 \|r,wU:9.10,wD:3.2,TLB:6:5:41:8.7.9,6:7:4.5.40:41,THB:9:7:4:40.39.41,9:39:4:8.6.7,10:9:4.5.40:41,(3.59,2.27,;3.07,1.15,;3.78,.15,;1.56,1.02,;1.56,2.59,;.12,3.07,;-1.2,2.69,;-1.2,1.02,;.34,.44,;-2.19,-.22,;-3.39,-1.17,;-4.82,-.59,;-6.03,-1.54,;-7.46,-.97,;-7.68,.56,;-6.46,1.51,;-5.03,.93,;-9.1,1.13,;-10.07,.37,;-9.32,2.66,;-10.75,3.24,;-10.96,4.76,;-12.39,5.34,;-12.61,6.87,;-11.63,7.62,;-14.03,7.44,;-14.25,8.97,;-15.68,9.54,;-16.89,8.59,;-16.67,7.07,;-15.25,6.49,;-18.32,9.17,;-19.53,8.21,;-19.36,6.99,;-20.96,8.79,;-21.18,10.31,;-19.97,11.26,;-18.54,10.69,;-17.57,11.45,;-.95,.32,;-1,2.05,;.56,-.22,)\|
BDBM50117193	OC(=O)[C@@]12CC3CC(C1)[C@H](Oc1ccc(cc1)C(=O)NCCNC(=O)c1ccc(cc1)-c1c(Cl)cccc1Cl)C(C3)C2 \|r,wU:9.10,wD:3.2,TLB:6:5:41:8.7.9,6:7:4.5.40:41,THB:9:7:4:40.39.41,9:39:4:8.6.7,10:9:4.5.40:41,(3.59,2.27,;3.07,1.15,;3.78,.15,;1.56,1.02,;1.56,2.59,;.12,3.07,;-1.2,2.69,;-1.2,1.02,;.34,.44,;-2.19,-.22,;-3.39,-1.17,;-4.82,-.59,;-6.03,-1.54,;-7.46,-.97,;-7.68,.56,;-6.46,1.51,;-5.03,.93,;-9.1,1.13,;-10.07,.37,;-9.32,2.66,;-10.75,3.24,;-10.96,4.76,;-12.39,5.34,;-12.61,6.87,;-11.63,7.62,;-14.03,7.44,;-14.25,8.97,;-15.68,9.54,;-16.89,8.59,;-16.67,7.07,;-15.25,6.49,;-18.32,9.17,;-19.53,8.21,;-19.36,6.99,;-20.96,8.79,;-21.18,10.31,;-19.97,11.26,;-18.54,10.69,;-17.57,11.45,;-.95,.32,;-1,2.05,;.56,-.22,)\|
BDBM50117194	OC(=O)[C@@]12CC3CC(C1)[C@H](Oc1ccc(cc1)C(=O)NCCNC(=O)c1ccc(c(Cl)c1)-c1ccccc1)C(C3)C2 \|r,wU:9.10,wD:3.2,TLB:6:5:40:8.7.9,6:7:4.5.39:40,THB:9:7:4:39.38.40,9:38:4:8.6.7,10:9:4.5.39:40,(3.59,2.27,;3.07,1.15,;3.78,.15,;1.56,1.02,;1.56,2.59,;.12,3.07,;-1.2,2.69,;-1.2,1.02,;.34,.44,;-2.19,-.22,;-3.39,-1.17,;-4.82,-.59,;-6.03,-1.54,;-7.46,-.97,;-7.68,.56,;-6.46,1.51,;-5.03,.93,;-9.1,1.13,;-10.07,.37,;-9.32,2.66,;-10.75,3.24,;-10.96,4.76,;-12.39,5.34,;-12.61,6.87,;-11.63,7.62,;-14.03,7.44,;-14.25,8.97,;-15.68,9.54,;-16.89,8.59,;-16.67,7.07,;-17.64,6.31,;-15.25,6.49,;-18.32,9.17,;-18.54,10.69,;-19.97,11.26,;-21.18,10.31,;-20.96,8.79,;-19.53,8.21,;-.95,.32,;-1,2.05,;.56,-.22,)\|
BDBM50117195	OC(=O)[C@@]12CC3CC(C1)[C@H](Oc1ccc(cc1)C(=O)NCCNC(=O)c1ccc(cc1)-c1ccccc1Cl)C(C3)C2 \|r,wU:9.10,wD:3.2,TLB:6:5:40:8.7.9,6:7:4.5.39:40,THB:9:7:4:39.38.40,9:38:4:8.6.7,10:9:4.5.39:40,(3.59,2.27,;3.07,1.15,;3.78,.15,;1.56,1.02,;1.56,2.59,;.12,3.07,;-1.2,2.69,;-1.2,1.02,;.34,.44,;-2.19,-.22,;-3.39,-1.17,;-4.82,-.59,;-6.03,-1.54,;-7.46,-.97,;-7.68,.56,;-6.46,1.51,;-5.03,.93,;-9.1,1.13,;-10.07,.37,;-9.32,2.66,;-10.75,3.24,;-10.96,4.76,;-12.39,5.34,;-12.61,6.87,;-11.63,7.62,;-14.03,7.44,;-14.25,8.97,;-15.68,9.54,;-16.89,8.59,;-16.67,7.07,;-15.25,6.49,;-18.32,9.17,;-19.53,8.21,;-20.96,8.79,;-21.18,10.31,;-19.97,11.26,;-18.54,10.69,;-17.57,11.45,;-.95,.32,;-1,2.05,;.56,-.22,)\|
BDBM50117196	OC(=O)[C@@]12CC3CC(C1)[C@H](Oc1ccc(cc1)C(=O)NCCNC(=O)c1ccc(cc1)-c1ccccc1C(F)(F)F)C(C3)C2 \|r,wU:9.10,wD:3.2,TLB:6:5:43:8.7.9,6:7:4.5.42:43,THB:9:7:4:42.41.43,9:41:4:8.6.7,10:9:4.5.42:43,(3.59,2.27,;3.07,1.15,;3.78,.15,;1.56,1.02,;1.56,2.59,;.12,3.07,;-1.2,2.69,;-1.2,1.02,;.34,.44,;-2.19,-.22,;-3.39,-1.17,;-4.82,-.59,;-6.03,-1.54,;-7.46,-.97,;-7.68,.56,;-6.46,1.51,;-5.03,.93,;-9.1,1.13,;-10.07,.37,;-9.32,2.66,;-10.75,3.24,;-10.96,4.76,;-12.39,5.34,;-12.61,6.87,;-11.63,7.62,;-14.03,7.44,;-14.25,8.97,;-15.68,9.54,;-16.89,8.59,;-16.67,7.07,;-15.25,6.49,;-18.32,9.17,;-19.53,8.21,;-20.96,8.79,;-21.18,10.31,;-19.97,11.26,;-18.54,10.69,;-17.33,11.64,;-17.5,12.86,;-16.19,11.19,;-16.36,12.4,;-.95,.32,;-1,2.05,;.56,-.22,)\|
BDBM50117197	OC(=O)C12CC3CC(C1)C(Oc1ccc(cc1)C(=O)NCCCNC(=O)c1ccc(cc1)-c1ccccc1)C(C3)C2 \|TLB:6:5:40:8.7.9,6:7:4.5.39:40,THB:9:7:4:39.38.40,9:38:4:8.6.7,10:9:4.5.39:40,(3.79,.17,;3.07,1.17,;3.58,2.29,;1.56,1.02,;1.56,2.59,;.12,3.07,;-1.2,2.69,;-1.2,1.02,;.34,.44,;-2.19,-.22,;-3.39,-1.16,;-3.17,-2.69,;-4.38,-3.64,;-4.16,-5.17,;-2.73,-5.74,;-1.52,-4.78,;-1.74,-3.26,;-2.5,-7.26,;-3.47,-8.03,;-1.07,-7.83,;-.85,-9.36,;.59,-9.92,;.81,-11.45,;2.24,-12.02,;2.47,-13.54,;1.5,-14.31,;3.9,-14.11,;4.13,-15.63,;5.56,-16.2,;6.76,-15.24,;6.54,-13.72,;5.1,-13.15,;8.2,-15.81,;8.43,-17.33,;9.86,-17.89,;11.06,-16.93,;10.83,-15.41,;9.4,-14.85,;-.95,.32,;-1,2.05,;.56,-.22,)\|
BDBM50117199	OC(=O)C12CC3CC(C1)C(Oc1ccc(cc1)C(=O)NCCCNC(=O)c1ccc4ccccc4c1)C(C3)C2 \|TLB:6:5:38:8.7.9,6:7:4.5.37:38,THB:9:7:4:37.36.38,9:36:4:8.6.7,10:9:4.5.37:38,(3.79,.17,;3.07,1.17,;3.58,2.29,;1.56,1.02,;1.56,2.59,;.12,3.07,;-1.2,2.69,;-1.2,1.02,;.34,.44,;-2.19,-.22,;-3.39,-1.16,;-3.17,-2.69,;-4.38,-3.64,;-4.16,-5.17,;-2.73,-5.74,;-1.52,-4.78,;-1.74,-3.26,;-2.5,-7.26,;-3.47,-8.03,;-1.07,-7.83,;-.85,-9.36,;.59,-9.92,;.81,-11.45,;2.24,-12.02,;2.47,-13.54,;1.5,-14.31,;3.9,-14.11,;4.13,-15.63,;5.57,-16.19,;6.78,-15.24,;8.21,-15.8,;9.41,-14.84,;9.18,-13.32,;7.75,-12.76,;6.55,-13.71,;5.12,-13.15,;-.95,.32,;-1,2.05,;.56,-.22,)\|
BDBM50117200	OC(=O)CC1C2CC3CC1CC(C3)(C2)Oc1ccc(cc1)C(=O)NCCNC(=O)c1ccc2ccccc2c1 \|TLB:8:9:12.7.6:13,8:7:13:9.4.10,4:5:12:9.8.10,THB:3:4:12.7.6:13,4:9:12:6.13.5,(-2.02,-3.15,;-3.17,-2.69,;-4.14,-3.45,;-3.39,-1.16,;-2.19,-.22,;-.95,.32,;-1,2.05,;.12,3.07,;-1.2,2.69,;-1.2,1.02,;.34,.44,;1.56,1.02,;1.56,2.59,;.56,-.22,;3.07,1.17,;3.7,2.57,;2.8,3.82,;3.43,5.23,;4.96,5.39,;5.87,4.14,;5.24,2.73,;5.59,6.79,;6.82,6.92,;4.69,8.04,;5.31,9.45,;4.41,10.7,;5.04,12.1,;4.13,13.35,;2.91,13.22,;4.76,14.76,;3.86,16,;4.49,17.41,;6.01,17.56,;6.64,18.97,;8.19,19.13,;9.09,17.89,;8.44,16.47,;6.92,16.32,;6.29,14.91,)\|
BDBM220987	Cc1cc(OCC(C)(C)C(O)=O)ncc1-c1cnc(-c2ncc([nH]2)C2(CC2)C(F)(F)F)c(C)c1
BDBM220988	CC(C)Cc1cnc([nH]1)-c1ccc(cc1C)-c1cnc(OCC(C)(C)C(O)=O)cc1C
BDBM220989	CC(C)Cc1cnc([nH]1)-c1ccc(cc1)-c1cnc(OCC(C)(C)C(O)=O)cc1C
BDBM220991	CC(C)(COc1ncc(cn1)-c1ccc(nc1)-c1ncc([nH]1)C(F)(F)F)C(O)=O
BDBM220992	Cc1cc(OCC(C)(C)C(O)=O)ncc1-c1cnc(-c2ncc([nH]2)C(F)(F)F)c(F)c1
BDBM220993	Cc1cc(OCC(C)(C)C(O)=O)ncc1-c1ccc(cc1)-c1ncc(CC2CC2)[nH]1
BDBM220994	Cc1cc(ccc1-c1ncc(CC2CC2)[nH]1)-c1cnc(OCC(C)(C)C(O)=O)cc1C
BDBM220995	Cc1cc(ccc1-c1ncc([nH]1)C(F)(F)F)-c1cnc(OCC(C)(C)C(O)=O)c(F)c1
BDBM220996	CC(C)(COc1ncc(cc1F)-c1ccc(cc1)-c1ncc([nH]1)C1(CC1)C(F)(F)F)C(O)=O
BDBM220997	Cc1cc(OCC(C)(C)C(O)=O)ncc1-c1cnc(-c2ncc([nH]2)C(F)(F)F)c(Cl)c1
BDBM220998	Cc1cc(OCC(C)(C)C(O)=O)ncc1-c1ccc(-c2ncc([nH]2)C(F)(F)F)c(c1)[N+]#[C-]
BDBM221000	Cc1cc(OCC(C)(C)C(O)=O)ncc1-c1ccc(-c2ncc([nH]2)C(C)(C)C(F)(F)F)c(F)c1
BDBM221001	Cc1cc(OCC(C)(C)C(O)=O)ncc1-c1ccc(nc1)-c1ncc([nH]1)C(F)(F)C(F)(F)F
BDBM221002	CC(C)Cc1cnc([nH]1)-c1ccc(cn1)-c1cnc(OCC(C)(C)C(O)=O)cc1C
BDBM221003	Cc1cc(OCC(C)(C)C(O)=O)ncc1-c1ccc(nc1)-c1ncc(CC2CC2)[nH]1
BDBM221004	CC(C)Cc1cnc([nH]1)-c1ccc(cc1F)-c1cnc(OCC(C)(C)C(O)=O)cc1C
BDBM221005	CC(C)Cc1cnc([nH]1)-c1ccc(cc1Cl)-c1cnc(OCC(C)(C)C(O)=O)cc1C
BDBM221006	Cc1cc(OCC(C)(C)C(O)=O)ncc1-c1ccc(-c2ncc(CC3CC3)[nH]2)c(Cl)c1
BDBM221007	Cc1cc(OCC(C)(C)C(O)=O)ncc1-c1ccc(cc1)-c1ncc([nH]1)C(F)(F)C(F)(F)F
BDBM221008	Cc1cc(ccc1-c1ncc([nH]1)C(F)(F)C(F)(F)F)-c1cnc(OCC(C)(C)C(O)=O)cc1C
BDBM221015	Cc1cc(OCC(C)(C)C(O)=O)ncc1-c1ccc(-c2ncc([nH]2)C(F)(F)F)c(c1)C(F)(F)F
BDBM221016	Cc1cc(OCC(C)(C)C(O)=O)ncc1-c1ccc(-c2ncc([nH]2)C(F)(F)F)c(c1)C1CC1
BDBM221017	Cc1cc(OCC2(CC2)C(O)=O)ncc1-c1ccc(nc1)-c1ncc([nH]1)C(F)(F)F
BDBM221018	Cc1cc(OCC2(CC2)C(O)=O)ncc1-c1ccc(-c2ncc([nH]2)C(F)(F)F)c(F)c1
BDBM221019	CCC(CC)(COc1cc(C)c(cn1)-c1ccc(-c2ncc([nH]2)C(F)(F)F)c(F)c1)C(O)=O
BDBM221020	Cc1cc(OCC(C)(C)C(O)=O)ncc1-c1cnc(-c2ncc([nH]2)C(F)(F)C(F)(F)F)c(Cl)c1
BDBM221009	Cc1cc(OCC(C)(C)C(O)=O)ncc1-c1ccc(-c2ncc([nH]2)C(F)(F)C(F)(F)F)c(F)c1
BDBM221010	Cc1cc(OCC(C)(C)C(O)=O)ncc1-c1ccc(-c2ncc([nH]2)C(F)(F)C(F)(F)F)c(Cl)c1
BDBM221011	Cc1cc(OCC(C)(C)C(O)=O)ncc1-c1cnc(nc1)-c1ncc([nH]1)C(F)(F)F
BDBM221012	CCC(CC)(COc1cc(C)c(cn1)-c1ccc(nc1)-c1ncc([nH]1)C(F)(F)F)C(O)=O
BDBM221013	CC(C)(COc1cnc(cn1)-c1ccc(nc1)-c1ncc([nH]1)C1(CC1)C(F)(F)F)C(O)=O
BDBM221014	COc1cc(ccc1-c1ncc([nH]1)C(F)(F)F)-c1cnc(OCC(C)(C)C(O)=O)cc1C
BDBM221021	Cc1cc(OCC2(CC2)C(O)=O)ncc1-c1cnc(-c2ncc([nH]2)C(F)(F)F)c(F)c1
BDBM221022	Cc1cc(OCC2(CCC2)C(O)=O)ncc1-c1cnc(-c2ncc([nH]2)C(F)(F)F)c(F)c1
BDBM221023	CCC(CC)(COc1cc(C)c(cn1)-c1cnc(-c2ncc([nH]2)C(F)(F)F)c(F)c1)C(O)=O
BDBM221024	Cc1cc(OCC2(CC2)C(O)=O)ncc1-c1cnc(-c2ncc([nH]2)C(F)(F)F)c(Cl)c1
BDBM221025	CCC(CC)(COc1cc(C)c(cn1)-c1ccc(-c2ncc([nH]2)C(F)(F)F)c(Cl)c1)C(O)=O
BDBM221026	CC(C)(COc1ccc(cn1)-c1cnc(-c2ncc([nH]2)C(F)(F)F)c(F)c1)C(O)=O
BDBM221027	CC(C)(COc1ccc(cn1)-c1cnc(-c2ncc([nH]2)C(F)(F)F)c(Cl)c1)C(O)=O
BDBM221028	CC(C)(COc1ncc(cc1F)-c1ccc(cc1)-c1ncc([nH]1)C(C)(C)C(F)(F)F)C(O)=O
BDBM221029	CC(C)(COc1ncc(cc1F)-c1ccc(cc1)-c1ncc([nH]1)C1(CCC1)C(F)(F)F)C(O)=O
BDBM221031	COc1cc(cnc1-c1ncc([nH]1)C(F)(F)F)-c1cnc(OCC2(CCC2)C(O)=O)cc1C
BDBM221032	Cc1cc(OCC2(CCC2)C(O)=O)ncc1-c1cnc(cn1)-c1ncc([nH]1)C(F)(F)F
BDBM221033	Cc1cc(OCC(C)(C)C(O)=O)ncc1-c1cnc(cn1)-c1ncc([nH]1)C(F)(F)C(F)(F)F
BDBM223504	OC(=O)C[C@H]1CCC(CC1)c1ccc(NC(=O)CCNC(=O)c2nc(oc2C(F)(F)F)-c2ccc(Br)cc2)cc1 \|r,wD:4.3,(12.93,2.21,;12.93,3.75,;14.27,4.52,;11.6,4.52,;10.27,3.75,;8.93,4.52,;7.6,3.75,;7.6,2.21,;8.93,1.44,;10.27,2.21,;6.27,1.44,;4.93,2.21,;3.6,1.44,;3.6,-.1,;2.26,-.87,;.93,-.1,;.93,1.44,;-.4,-.87,;-1.74,-.1,;-3.07,-.87,;-4.4,-.1,;-4.4,1.44,;-5.74,-.87,;-7.2,-.4,;-8.11,-1.64,;-7.2,-2.89,;-5.65,-2.43,;-4.39,-3.32,;-3.13,-4.21,;-5.27,-4.58,;-3.5,-2.06,;-9.65,-1.64,;-10.42,-.31,;-11.96,-.31,;-12.73,-1.64,;-14.27,-1.64,;-11.96,-2.98,;-10.42,-2.98,;4.93,-.87,;6.27,-.1,)\|
BDBM223505	Cc1oc(nc1C(=O)NCCC(=O)Nc1ccc(cc1)C1CC[C@H](CC(O)=O)CC1)-c1ccccc1 \|r,wD:23.25,$;;;;;;;;HN;;;;;HN;;;;;;;;;;;;;;;;;;;;;;$,(-5.17,3.85,;-6.51,3.08,;-7.97,3.56,;-8.88,2.31,;-7.97,1.06,;-6.51,1.54,;-5.17,.77,;-5.17,-.77,;-3.84,1.54,;-2.51,.77,;-1.17,1.54,;.16,.77,;.16,-.77,;1.49,1.54,;2.83,.77,;2.83,-.77,;4.16,-1.54,;5.5,-.77,;5.5,.77,;4.16,1.54,;6.83,-1.54,;8.16,-.77,;9.5,-1.54,;9.5,-3.08,;10.83,-3.85,;12.16,-3.08,;13.5,-3.85,;12.16,-1.54,;8.16,-3.85,;6.83,-3.08,;-10.42,2.31,;-11.19,3.64,;-12.73,3.64,;-13.5,2.31,;-12.73,.98,;-11.19,.98,)\|
BDBM223506	Cc1nc(sc1C(=O)NCCC(=O)Nc1ccc(cc1)C1CC[C@H](CC(O)=O)CC1)-c1ccccc1 \|r,wD:23.25,$;;;;;;;;HN;;;;;HN;;;;;;;;;;;;;;;;;;;;;;$,(-5.25,3.85,;-6.59,3.08,;-8.05,3.56,;-8.96,2.31,;-8.05,1.06,;-6.59,1.54,;-5.25,.77,;-5.25,-.77,;-3.92,1.54,;-2.59,.77,;-1.25,1.54,;.08,.77,;.08,-.77,;1.42,1.54,;2.75,.77,;2.75,-.77,;4.08,-1.54,;5.42,-.77,;5.42,.77,;4.08,1.54,;6.75,-1.54,;8.08,-.77,;9.42,-1.54,;9.42,-3.08,;10.75,-3.85,;12.09,-3.08,;13.42,-3.85,;12.09,-1.54,;8.08,-3.85,;6.75,-3.08,;-10.44,1.91,;-11.53,3,;-13.02,2.6,;-13.42,1.11,;-12.33,.03,;-10.84,.42,)\|
BDBM223507	OC(=O)C[C@H]1CCC(CC1)c1ccc(NC(=O)CCNC(=O)c2sc(nc2C(F)(F)F)-c2ccccc2)cc1 \|r,wD:4.3,$;;;;;;;;;;;;;;HN;;;;;HN;;;;;;;;;;;;;;;;;;;$,(13.5,-4.52,;12.16,-3.75,;12.16,-2.21,;10.83,-4.52,;9.5,-3.75,;9.5,-2.21,;8.16,-1.44,;6.83,-2.21,;6.83,-3.75,;8.16,-4.52,;5.5,-1.44,;4.16,-2.21,;2.83,-1.44,;2.83,.1,;1.49,.87,;.16,.1,;.16,-1.44,;-1.17,.87,;-2.51,.1,;-3.84,.87,;-5.17,.1,;-5.17,-1.44,;-6.51,.87,;-7.97,.4,;-8.88,1.64,;-7.97,2.89,;-6.47,2.44,;-5.23,3.34,;-3.98,4.25,;-6.13,4.59,;-4.32,2.1,;-10.42,1.64,;-11.19,.31,;-12.73,.31,;-13.5,1.64,;-12.73,2.98,;-11.19,2.98,;4.16,.87,;5.5,.1,)\|
BDBM223520	OC(=O)C[C@H]1CCC(CC1)c1ccc(NC(=O)CCNC(=O)c2nc(oc2C(F)(F)F)-c2c(F)cccc2Cl)cc1 \|r,wD:4.3,$;;;;;;;;;;;;;;HN;;;;;HN;;;;;;;;;;;;;;;;;;;;;$,(13.5,-4.52,;12.16,-3.75,;12.16,-2.21,;10.83,-4.52,;9.5,-3.75,;9.5,-2.21,;8.16,-1.44,;6.83,-2.21,;6.83,-3.75,;8.16,-4.52,;5.5,-1.44,;4.16,-2.21,;2.83,-1.44,;2.83,.1,;1.49,.87,;.16,.1,;.16,-1.44,;-1.17,.87,;-2.51,.1,;-3.84,.87,;-5.17,.1,;-5.17,-1.44,;-6.51,.87,;-7.97,.4,;-8.88,1.64,;-7.97,2.89,;-6.47,2.44,;-5.23,3.34,;-3.98,4.25,;-6.13,4.59,;-4.32,2.1,;-10.42,1.64,;-11.19,.31,;-10.42,-1.02,;-12.73,.31,;-13.5,1.64,;-12.73,2.98,;-11.19,2.98,;-10.42,4.31,;4.16,.87,;5.5,.1,)\|
BDBM223521	Cc1cccc(C)c1-c1ccc(cc1)C(=O)NCCC(=O)Nc1ccc(cc1)C1CC[C@H](CC(O)=O)CC1 \|r,wD:31.34,$;;;;;;;;;;;;;;;;HN;;;;;HN;;;;;;;;;;;;;;;;$,(-9.34,5.01,;-10.67,4.24,;-12,5.01,;-13.34,4.24,;-13.34,2.7,;-12,1.93,;-12,.39,;-10.67,2.7,;-9.34,1.93,;-8,2.7,;-6.67,1.93,;-6.67,.39,;-8,-.39,;-9.34,.39,;-5.33,-.39,;-5.33,-1.93,;-4,.39,;-2.67,-.39,;-1.33,.39,;,-.39,;,-1.93,;1.33,.39,;2.67,-.39,;2.67,-1.93,;4,-2.7,;5.33,-1.93,;5.33,-.39,;4,.39,;6.67,-2.7,;8,-1.93,;9.34,-2.7,;9.34,-4.24,;10.67,-5.01,;12,-4.24,;13.34,-5.01,;12,-2.7,;8,-5.01,;6.67,-4.24,)\|
BDBM223522	[O-]C(=O)C[C@H]1CCC(CC1)c1ccc(NC(=O)CCNC(=O)c2nc(oc2C(F)(F)F)-c2ccccc2Cl)cc1 \|r,wU:4.3,$;;;;;;;;;;;;;;HN;;;;;HN;;;;;;;;;;;;;;;;;;;;$,(9.01,-6.37,;10.34,-5.6,;11.67,-6.37,;10.34,-4.06,;9.01,-3.29,;7.67,-4.06,;6.34,-3.29,;6.34,-1.75,;7.67,-.98,;9.01,-1.75,;5,-.98,;5,.56,;3.67,1.33,;2.34,.56,;1,1.33,;-.33,.56,;-.33,-.98,;-1.66,1.33,;-3,.56,;-4.33,1.33,;-5.66,.56,;-5.66,-.98,;-7,1.33,;-8.41,.7,;-9.44,1.84,;-8.67,3.18,;-7.16,2.86,;-6.02,3.89,;-4.87,4.92,;-7.05,5.03,;-4.98,2.74,;-10.97,1.68,;-11.87,2.93,;-13.4,2.77,;-14.03,1.36,;-13.13,.12,;-11.59,.28,;-10.69,-.97,;2.34,-.98,;3.67,-1.75,)\|
BDBM223523	OC(=O)C[C@H]1CCC(CC1)c1ccc(NC(=O)CCNC(=O)c2ccc(cc2)-c2ccccc2Cl)cc1 \|r,wD:4.3,$;;;;;;;;;;;;;;HN;;;;;HN;;;;;;;;;;;;;;;;;$,(13.7,-5,;12.18,-4.23,;12.18,-2.69,;10.67,-5,;9.16,-4.23,;9.16,-2.69,;7.82,-1.92,;6.49,-2.69,;6.49,-4.23,;7.82,-5,;5.15,-1.92,;3.82,-2.69,;2.49,-1.92,;2.49,-.38,;1.15,.39,;-.18,-.38,;-.18,-1.92,;-1.51,.39,;-2.85,-.38,;-4.18,.39,;-5.52,-.38,;-5.52,-1.92,;-6.85,.39,;-6.85,1.92,;-8.18,2.69,;-9.52,1.92,;-9.52,.39,;-8.18,-.38,;-11.03,2.69,;-12.36,1.92,;-13.7,2.69,;-13.7,4.23,;-12.36,5,;-11.03,4.23,;-9.7,5,;3.82,.39,;5.15,-.38,)\|
BDBM223496	CCOc1ccc(cc1)C(=O)NCCC(=O)Nc1ccc(cc1)C1CC[C@H](CC(O)=O)CC1 \|r,wD:26.28,(-13.34,-3.85,;-12,-3.08,;-10.67,-3.85,;-9.34,-3.08,;-9.34,-1.54,;-8,-.77,;-6.67,-1.54,;-6.67,-3.08,;-8,-3.85,;-5.33,-.77,;-5.33,.77,;-4,-1.54,;-2.67,-.77,;-1.33,-1.54,;,-.77,;,.77,;1.33,-1.54,;2.67,-.77,;4,-1.54,;5.33,-.77,;5.33,.77,;4,1.54,;2.67,.77,;6.67,1.54,;6.67,3.08,;8,3.85,;9.34,3.08,;10.67,3.85,;12,3.08,;13.34,3.85,;12,1.54,;9.34,1.54,;8,.77,)\|
BDBM223497	OC(=O)C[C@H]1CCC(CC1)c1ccc(NC(=O)CCNC(=O)c2nc(oc2C(F)(F)F)-c2ccccc2)cc1 \|r,wD:4.3,$;;;;;;;;;;;;;;HN;;;;;HN;;;;;;;;;;;;;;;;;;;$,(13.5,-4.52,;12.16,-3.75,;12.16,-2.21,;10.83,-4.52,;9.5,-3.75,;9.5,-2.21,;8.16,-1.44,;6.83,-2.21,;6.83,-3.75,;8.16,-4.52,;5.5,-1.44,;4.16,-2.21,;2.83,-1.44,;2.83,.1,;1.49,.87,;.16,.1,;.16,-1.44,;-1.17,.87,;-2.51,.1,;-3.84,.87,;-5.17,.1,;-5.17,-1.44,;-6.51,.87,;-7.97,.4,;-8.88,1.64,;-7.97,2.89,;-6.51,2.41,;-5.26,3.32,;-4.02,4.22,;-6.17,4.56,;-4.36,2.07,;-10.42,1.64,;-11.19,2.98,;-12.73,2.98,;-13.5,1.64,;-12.73,.31,;-11.19,.31,;4.16,.87,;5.5,.1,)\|
BDBM223498	OC(=O)C[C@H]1CCC(CC1)c1ccc(NC(=O)CCNC(=O)c2cn(nc2C(F)(F)F)-c2ccccc2)cc1 \|r,wD:4.3,(12.3,5.78,;10.97,5.01,;10.97,3.47,;9.64,5.78,;8.3,5.01,;6.97,5.78,;5.64,5.01,;5.64,3.47,;6.97,2.7,;8.3,3.47,;4.3,2.7,;4.3,1.16,;2.97,.39,;1.64,1.16,;.3,.39,;-1.03,1.16,;-1.03,2.7,;-2.37,.39,;-3.7,1.16,;-5.03,.39,;-6.37,1.16,;-6.37,2.7,;-7.7,.39,;-7.7,-1.15,;-9.17,-1.63,;-10.07,-.38,;-9.17,.87,;-9.94,2.2,;-10.71,3.53,;-11.27,1.43,;-8.6,2.97,;-9.98,-3.11,;-11.52,-3.1,;-12.3,-4.42,;-11.55,-5.76,;-10.01,-5.78,;-9.22,-4.46,;1.64,2.7,;2.97,3.47,)\|
BDBM223499	OC(=O)C[C@H]1CCC(CC1)c1ccc(NC(=O)CCNC(=O)c2nc(oc2C(F)(F)F)-c2ccccc2Cl)cc1 \|r,wD:4.3,$;;;;;;;;;;;;;;HN;;;;;HN;;;;;;;;;;;;;;;;;;;;$,(13.5,-4.52,;12.16,-3.75,;12.16,-2.21,;10.83,-4.52,;9.5,-3.75,;9.5,-2.21,;8.16,-1.44,;6.83,-2.21,;6.83,-3.75,;8.16,-4.52,;5.5,-1.44,;4.16,-2.21,;2.83,-1.44,;2.83,.1,;1.49,.87,;.16,.1,;.16,-1.44,;-1.17,.87,;-2.51,.1,;-3.84,.87,;-5.17,.1,;-5.17,-1.44,;-6.51,.87,;-7.97,.4,;-8.88,1.64,;-7.97,2.89,;-6.51,2.41,;-5.26,3.32,;-4.02,4.22,;-6.17,4.56,;-4.36,2.07,;-10.42,1.64,;-11.19,2.98,;-12.73,2.98,;-13.5,1.64,;-12.73,.31,;-11.19,.31,;-10.42,-1.02,;4.16,.87,;5.5,.1,)\|
BDBM223508	NC(=O)C[C@H]1CCC(CC1)c1ccc(NC(=O)CCNC(=O)c2nc(oc2C(F)(F)F)-c2ccccc2)cc1 \|r,wD:4.3,(13.5,-4.52,;12.16,-3.75,;12.16,-2.21,;10.83,-4.52,;9.5,-3.75,;9.5,-2.21,;8.16,-1.44,;6.83,-2.21,;6.83,-3.75,;8.16,-4.52,;5.5,-1.44,;4.16,-2.21,;2.83,-1.44,;2.83,.1,;1.49,.87,;.16,.1,;.16,-1.44,;-1.17,.87,;-2.51,.1,;-3.84,.87,;-5.17,.1,;-5.17,-1.44,;-6.51,.87,;-7.97,.4,;-8.88,1.64,;-7.97,2.89,;-6.47,2.44,;-5.23,3.34,;-3.98,4.25,;-6.13,4.59,;-4.32,2.1,;-10.42,1.64,;-11.19,.31,;-12.73,.31,;-13.5,1.64,;-12.73,2.98,;-11.19,2.98,;4.16,.87,;5.5,.1,)\|
BDBM223518	OC(=O)C[C@H]1CCC(CC1)c1ccc(NC(=O)CCNC(=O)c2nc(oc2C(F)(F)F)-c2c(Cl)cccc2Cl)cc1 \|r,wD:4.3,$;;;;;;;;;;;;;;HN;;;;;HN;;;;;;;;;;;;;;;;;;;;;$,(13.5,-4.52,;12.16,-3.75,;12.16,-2.21,;10.83,-4.52,;9.5,-3.75,;9.5,-2.21,;8.16,-1.44,;6.83,-2.21,;6.83,-3.75,;8.16,-4.52,;5.5,-1.44,;4.16,-2.21,;2.83,-1.44,;2.83,.1,;1.49,.87,;.16,.1,;.16,-1.44,;-1.17,.87,;-2.51,.1,;-3.84,.87,;-5.17,.1,;-5.17,-1.44,;-6.51,.87,;-7.97,.4,;-8.88,1.64,;-7.97,2.89,;-6.47,2.44,;-5.23,3.34,;-3.98,4.25,;-6.13,4.59,;-4.32,2.1,;-10.42,1.64,;-11.19,2.98,;-10.42,4.31,;-12.73,2.98,;-13.5,1.64,;-12.73,.31,;-11.19,.31,;-10.42,-1.02,;4.16,.87,;5.5,.1,)\|
BDBM223519	[O-]C(=O)C[C@H]1CCC(CC1)c1ccc(NC(=O)CCNC(=O)c2nc(oc2C(F)(F)F)-c2c(Cl)cccc2Cl)cc1 \|r,wU:4.3,$;;;;;;;;;;;;;;HN;;;;;HN;;;;;;;;;;;;;;;;;;;;;$,(8.39,-.06,;8.39,1.48,;9.72,2.25,;7.06,2.25,;5.72,1.48,;5.72,-.06,;4.39,-.83,;3.06,-.06,;3.06,1.48,;4.39,2.25,;1.72,-.83,;.39,-.06,;-.95,-.83,;-.95,-2.37,;-2.28,-3.14,;-2.28,-4.68,;-.95,-5.45,;-3.61,-5.45,;-4.95,-4.68,;-4.95,-3.14,;-6.28,-2.37,;-7.61,-3.14,;-6.28,-.83,;-5.03,.07,;-5.51,1.54,;-7.05,1.54,;-7.53,.07,;-8.99,-.4,;-10.46,-.88,;-9.47,1.06,;-8.51,-1.87,;-4.6,2.78,;-5.23,4.19,;-6.76,4.35,;-4.33,5.44,;-2.79,5.27,;-2.17,3.87,;-3.07,2.62,;-2.45,1.21,;.39,-3.14,;1.72,-2.37,)\|
BDBM223513	OC(=O)C[C@H]1CCC(CC1)c1ccc(NC(=O)CCNC(=O)c2ccc(OCC3CC3)cc2)cc1 \|r,wD:4.3,$;;;;;;;;;;;;;;HN;;;;;HN;;;;;;;;;;;;;;;$,(14.11,-4.52,;12.77,-3.75,;12.77,-2.21,;11.44,-4.52,;10.11,-3.75,;10.11,-2.21,;8.77,-1.44,;7.44,-2.21,;7.44,-3.75,;8.77,-4.52,;6.1,-1.44,;4.77,-2.21,;3.44,-1.44,;3.44,.1,;2.1,.87,;.77,.1,;.77,-1.44,;-.56,.87,;-1.9,.1,;-3.23,.87,;-4.56,.1,;-4.56,-1.44,;-5.9,.87,;-7.23,.1,;-8.57,.87,;-8.57,2.41,;-9.9,3.18,;-11.23,2.41,;-12.57,3.18,;-14.11,3.18,;-13.34,4.52,;-7.23,3.18,;-5.9,2.41,;4.77,.87,;6.1,.1,)\|
BDBM223514	OC(=O)C[C@H]1CCC(CC1)c1ccc(NC(=O)CCNC(=O)c2nc(oc2C(F)(F)F)-c2ccccc2F)cc1 \|r,wD:4.3,$;;;;;;;;;;;;;;HN;;;;;HN;;;;;;;;;;;;;;;;;;;;$,(13.5,-4.52,;12.16,-3.75,;12.16,-2.21,;10.83,-4.52,;9.5,-3.75,;9.5,-2.21,;8.16,-1.44,;6.83,-2.21,;6.83,-3.75,;8.16,-4.52,;5.5,-1.44,;4.16,-2.21,;2.83,-1.44,;2.83,.1,;1.49,.87,;.16,.1,;.16,-1.44,;-1.17,.87,;-2.51,.1,;-3.84,.87,;-5.17,.1,;-5.17,-1.44,;-6.51,.87,;-7.97,.4,;-8.88,1.64,;-7.97,2.89,;-6.47,2.44,;-5.23,3.34,;-3.98,4.25,;-6.13,4.59,;-4.32,2.1,;-10.42,1.64,;-11.19,.31,;-12.73,.31,;-13.5,1.64,;-12.73,2.98,;-11.19,2.98,;-10.42,4.31,;4.16,.87,;5.5,.1,)\|
BDBM223515	OC(=O)C[C@H]1CCC(CC1)c1ccc(NC(=O)CCNC(=O)c2nc(oc2C(F)(F)F)-c2ccc(Cl)cc2Cl)cc1 \|r,wD:4.3,$;;;;;;;;;;;;;;HN;;;;;HN;;;;;;;;;;;;;;;;;;;;;$,(14.27,-4.52,;12.93,-3.75,;12.93,-2.21,;11.6,-4.52,;10.27,-3.75,;10.27,-2.21,;8.93,-1.44,;7.6,-2.21,;7.6,-3.75,;8.93,-4.52,;6.27,-1.44,;4.93,-2.21,;3.6,-1.44,;3.6,.1,;2.26,.87,;.93,.1,;.93,-1.44,;-.4,.87,;-1.74,.1,;-3.07,.87,;-4.4,.1,;-4.4,-1.44,;-5.74,.87,;-7.2,.4,;-8.11,1.64,;-7.2,2.89,;-5.7,2.44,;-4.46,3.34,;-3.21,4.25,;-5.36,4.59,;-3.55,2.1,;-9.65,1.64,;-10.42,2.98,;-11.96,2.98,;-12.73,1.64,;-14.27,1.64,;-11.96,.31,;-10.42,.31,;-9.65,-1.02,;4.93,.87,;6.27,.1,)\|
BDBM223516	OC(=O)C[C@H]1CCC(CC1)c1ccc(NC(=O)CCNC(=O)c2nc(oc2C(F)(F)F)-c2ccccc2Br)cc1 \|r,wD:4.3,$;;;;;;;;;;;;;;HN;;;;;HN;;;;;;;;;;;;;;;;;;;;$,(13.5,-4.52,;12.16,-3.75,;12.16,-2.21,;10.83,-4.52,;9.5,-3.75,;9.5,-2.21,;8.16,-1.44,;6.83,-2.21,;6.83,-3.75,;8.16,-4.52,;5.5,-1.44,;4.16,-2.21,;2.83,-1.44,;2.83,.1,;1.49,.87,;.16,.1,;.16,-1.44,;-1.17,.87,;-2.51,.1,;-3.84,.87,;-5.17,.1,;-5.17,-1.44,;-6.51,.87,;-7.97,.4,;-8.88,1.64,;-7.97,2.89,;-6.47,2.44,;-5.23,3.34,;-3.98,4.25,;-6.13,4.59,;-4.32,2.1,;-10.42,1.64,;-11.19,2.98,;-12.73,2.98,;-13.5,1.64,;-12.73,.31,;-11.19,.31,;-10.42,-1.02,;4.16,.87,;5.5,.1,)\|
BDBM223500	OC(=O)C[C@H]1CCC(CC1)c1ccc(NC(=O)CCNC(=O)c2oc(nc2C(F)(F)F)-c2ccccc2)cc1 \|r,wD:4.3,$;;;;;;;;;;;;;;HN;;;;;HN;;;;;;;;;;;;;;;;;;;$,(13.5,-4.52,;12.16,-3.75,;12.16,-2.21,;10.83,-4.52,;9.5,-3.75,;9.5,-2.21,;8.16,-1.44,;6.83,-2.21,;6.83,-3.75,;8.16,-4.52,;5.5,-1.44,;4.16,-2.21,;2.83,-1.44,;2.83,.1,;1.49,.87,;.16,.1,;.16,-1.44,;-1.17,.87,;-2.51,.1,;-3.84,.87,;-5.17,.1,;-5.17,-1.44,;-6.51,.87,;-7.97,.4,;-8.88,1.64,;-7.97,2.89,;-6.51,2.41,;-5.26,3.32,;-4.02,4.22,;-6.17,4.56,;-4.36,2.07,;-10.42,1.64,;-11.19,2.98,;-12.73,2.98,;-13.5,1.64,;-12.73,.31,;-11.19,.31,;4.16,.87,;5.5,.1,)\|
BDBM223501	Cc1ccc(cc1)-c1nc(C(=O)NCCC(=O)Nc2ccc(cc2)C2CC[C@H](CC(O)=O)CC2)c(o1)C(F)(F)F \|r,wD:27.29,$;;;;;;;;;;;;HN;;;;;HN;;;;;;;;;;;;;;;;;;;;;;$,(-14.27,1.64,;-12.73,1.64,;-11.96,.31,;-10.42,.31,;-9.65,1.64,;-10.42,2.98,;-11.96,2.98,;-8.11,1.64,;-7.2,.4,;-5.74,.87,;-4.4,.1,;-4.4,-1.44,;-3.07,.87,;-1.74,.1,;-.4,.87,;.93,.1,;.93,-1.44,;2.26,.87,;3.6,.1,;3.6,-1.44,;4.93,-2.21,;6.27,-1.44,;6.27,.1,;4.93,.87,;7.6,-2.21,;8.93,-1.44,;10.27,-2.21,;10.27,-3.75,;11.6,-4.52,;12.93,-3.75,;14.27,-4.52,;12.93,-2.21,;8.93,-4.52,;7.6,-3.75,;-5.7,2.44,;-7.2,2.89,;-4.46,3.34,;-3.21,4.25,;-5.36,4.59,;-3.55,2.1,)\|
BDBM223502	Cc1ccccc1-c1nc(C(=O)NCCC(=O)Nc2ccc(cc2)C2CC[C@H](CC(O)=O)CC2)c(o1)C(F)(F)F \|r,wD:27.29,$;;;;;;;;;;;;HN;;;;;HN;;;;;;;;;;;;;;;;;;;;;;$,(-10.42,4.31,;-11.19,2.98,;-12.73,2.98,;-13.5,1.64,;-12.73,.31,;-11.19,.31,;-10.42,1.64,;-8.88,1.64,;-7.97,.4,;-6.51,.87,;-5.17,.1,;-5.17,-1.44,;-3.84,.87,;-2.51,.1,;-1.17,.87,;.16,.1,;.16,-1.44,;1.49,.87,;2.83,.1,;2.83,-1.44,;4.16,-2.21,;5.5,-1.44,;5.5,.1,;4.16,.87,;6.83,-2.21,;8.16,-1.44,;9.5,-2.21,;9.5,-3.75,;10.83,-4.52,;12.16,-3.75,;13.5,-4.52,;12.16,-2.21,;8.16,-4.52,;6.83,-3.75,;-6.47,2.44,;-7.97,2.89,;-5.23,3.34,;-3.98,4.25,;-6.13,4.59,;-4.32,2.1,)\|
BDBM223503	FC(F)(F)c1oc(nc1C(=O)NCCC(=O)Nc1ccc(cc1)C1CC[C@H](CC(=O)O[Na])CC1)-c1ccccc1 \|r,wU:26.28,$;;;;;;;;;;;HN;;;;;HN;;;;;;;;;;;;;;;;;;;;;;;$,(-9.29,-2.88,;-8.97,-1.38,;-10.47,-1.06,;-7.46,-1.7,;-8.65,.13,;-9.68,1.27,;-8.91,2.61,;-7.4,2.29,;-7.24,.76,;-5.91,-.01,;-5.91,-1.55,;-4.57,.76,;-3.24,-.01,;-1.9,.76,;-.57,-.01,;-.57,-1.55,;.76,.76,;2.1,-.01,;3.43,.76,;4.76,-.01,;4.76,-1.55,;3.43,-2.32,;2.1,-1.55,;6.1,-2.32,;6.1,-3.86,;7.43,-4.63,;8.76,-3.86,;10.1,-4.63,;11.43,-3.86,;11.43,-2.32,;12.77,-4.63,;14.1,-3.86,;8.76,-2.32,;7.43,-1.55,;-9.53,4.02,;-8.63,5.26,;-9.25,6.67,;-10.79,6.83,;-11.69,5.58,;-11.06,4.18,)\|
BDBM223509	Cc1ccc(cc1)-n1cc(C(=O)NCCC(=O)Nc2ccc(cc2)C2CC[C@H](CC(O)=O)CC2)c(n1)C(F)(F)F \|r,wD:27.29,$;;;;;;;;;;;;HN;;;;;HN;;;;;;;;;;;;;;;;;;;;;;$,(-14.27,1.64,;-12.73,1.64,;-11.96,.31,;-10.42,.31,;-9.65,1.64,;-10.42,2.98,;-11.96,2.98,;-8.11,1.64,;-7.2,.4,;-5.74,.87,;-4.4,.1,;-4.4,-1.44,;-3.07,.87,;-1.74,.1,;-.4,.87,;.93,.1,;.93,-1.44,;2.26,.87,;3.6,.1,;3.6,-1.44,;4.93,-2.21,;6.27,-1.44,;6.27,.1,;4.93,.87,;7.6,-2.21,;8.93,-1.44,;10.27,-2.21,;10.27,-3.75,;11.6,-4.52,;12.93,-3.75,;14.27,-4.52,;12.93,-2.21,;8.93,-4.52,;7.6,-3.75,;-5.7,2.44,;-7.2,2.89,;-4.46,3.34,;-3.21,4.25,;-5.36,4.59,;-3.55,2.1,)\|
BDBM223510	OC(=O)C[C@H]1CCC(CC1)c1ccc(NC(=O)CCNC(=O)c2cn(nc2C(F)(F)F)-c2ccc(Cl)cc2)cc1 \|r,wD:4.3,$;;;;;;;;;;;;;;HN;;;;;HN;;;;;;;;;;;;;;;;;;;;$,(14.27,-4.52,;12.93,-3.75,;12.93,-2.21,;11.6,-4.52,;10.27,-3.75,;10.27,-2.21,;8.93,-1.44,;7.6,-2.21,;7.6,-3.75,;8.93,-4.52,;6.27,-1.44,;4.93,-2.21,;3.6,-1.44,;3.6,.1,;2.26,.87,;.93,.1,;.93,-1.44,;-.4,.87,;-1.74,.1,;-3.07,.87,;-4.4,.1,;-4.4,-1.44,;-5.74,.87,;-7.2,.4,;-8.11,1.64,;-7.2,2.89,;-5.7,2.44,;-4.46,3.34,;-3.21,4.25,;-5.36,4.59,;-3.55,2.1,;-9.65,1.64,;-10.42,.31,;-11.96,.31,;-12.73,1.64,;-14.27,1.64,;-11.96,2.98,;-10.42,2.98,;4.93,.87,;6.27,.1,)\|
BDBM223511	OC(=O)C[C@H]1CCC(CC1)c1ccc(NC(=O)CCNC(=O)c2cn(nc2C(F)(F)F)-c2ccccc2Cl)cc1 \|r,wD:4.3,$;;;;;;;;;;;;;;HN;;;;;HN;;;;;;;;;;;;;;;;;;;;$,(13.5,-4.52,;12.16,-3.75,;12.16,-2.21,;10.83,-4.52,;9.5,-3.75,;9.5,-2.21,;8.16,-1.44,;6.83,-2.21,;6.83,-3.75,;8.16,-4.52,;5.5,-1.44,;4.16,-2.21,;2.83,-1.44,;2.83,.1,;1.49,.87,;.16,.1,;.16,-1.44,;-1.17,.87,;-2.51,.1,;-3.84,.87,;-5.17,.1,;-5.17,-1.44,;-6.51,.87,;-7.97,.4,;-8.88,1.64,;-7.97,2.89,;-6.47,2.44,;-5.23,3.34,;-3.98,4.25,;-6.13,4.59,;-4.32,2.1,;-10.42,1.64,;-11.19,.31,;-12.73,.31,;-13.5,1.64,;-12.73,2.98,;-11.19,2.98,;-10.42,4.31,;4.16,.87,;5.5,.1,)\|
BDBM223512	OC(=O)C[C@H]1CCC(CC1)c1ccc(NC(=O)CCNC(=O)c2nc(oc2C(F)(F)F)-c2ccc(F)cc2)cc1 \|r,wD:4.3,$;;;;;;;;;;;;;;HN;;;;;HN;;;;;;;;;;;;;;;;;;;;$,(14.27,-4.52,;12.93,-3.75,;12.93,-2.21,;11.6,-4.52,;10.27,-3.75,;10.27,-2.21,;8.93,-1.44,;7.6,-2.21,;7.6,-3.75,;8.93,-4.52,;6.27,-1.44,;4.93,-2.21,;3.6,-1.44,;3.6,.1,;2.26,.87,;.93,.1,;.93,-1.44,;-.4,.87,;-1.74,.1,;-3.07,.87,;-4.4,.1,;-4.4,-1.44,;-5.74,.87,;-7.2,.4,;-8.11,1.64,;-7.2,2.89,;-5.7,2.44,;-4.46,3.34,;-3.21,4.25,;-5.36,4.59,;-3.55,2.1,;-9.65,1.64,;-10.42,.31,;-11.96,.31,;-12.73,1.64,;-14.27,1.64,;-11.96,2.98,;-10.42,2.98,;4.93,.87,;6.27,.1,)\|
BDBM223517	OC(=O)C[C@H]1CCC(CC1)c1ccc(NC(=O)CCNC(=O)c2nc(oc2C(F)(F)F)-c2ccccc2C(F)(F)F)cc1 \|r,wD:4.3,$;;;;;;;;;;;;;;HN;;;;;HN;;;;;;;;;;;;;;;;;;;;;;;$,(13.5,-5.08,;12.16,-4.31,;12.16,-2.77,;10.83,-5.08,;9.5,-4.31,;9.5,-2.77,;8.16,-2,;6.83,-2.77,;6.83,-4.31,;8.16,-5.08,;5.5,-2,;4.16,-2.77,;2.83,-2,;2.83,-.46,;1.49,.31,;.16,-.46,;.16,-2,;-1.17,.31,;-2.51,-.46,;-3.84,.31,;-5.17,-.46,;-5.17,-2,;-6.51,.31,;-7.97,-.17,;-8.88,1.08,;-7.97,2.33,;-6.47,1.87,;-5.23,2.78,;-3.98,3.68,;-6.13,4.02,;-4.32,1.53,;-10.42,1.08,;-11.19,-.25,;-12.73,-.25,;-13.5,1.08,;-12.73,2.41,;-11.16,2.46,;-10.39,3.79,;-9.62,5.13,;-11.72,4.56,;-9.06,3.02,;4.16,.31,;5.5,-.46,)\|
BDBM50117148	CC(C)(C)OC(=O)NCCNC(=O)c1ccc(OC2C3CC4CC2CC(C4)(C3)C(O)=O)cc1 \|TLB:18:19:26:22.23.24,17:18:26.21.22:24,THB:20:21:24:27.19.18,20:19:26.21.22:24,18:23:26:27.20.19,(4.08,-15.33,;3.9,-14.11,;4.87,-13.35,;5.04,-14.57,;2.47,-13.54,;2.24,-12.02,;3.21,-11.25,;.81,-11.45,;.59,-9.92,;-.85,-9.36,;-1.07,-7.83,;-2.5,-7.26,;-3.47,-8.03,;-2.73,-5.74,;-4.16,-5.17,;-4.38,-3.64,;-3.17,-2.69,;-3.39,-1.16,;-2.19,-.22,;-1.2,1.02,;-1.2,2.69,;.12,3.07,;-1,2.05,;-.95,.32,;.56,-.22,;1.56,1.02,;1.56,2.59,;.34,.44,;3.07,1.17,;3.79,.17,;3.58,2.29,;-1.74,-3.26,;-1.52,-4.78,)\|
BDBM50117151	Cc1ccccc1-c1ccc(cc1)C(=O)NCCNC(=O)c1ccc(O[C@H]2C3CC4CC2C[C@](C4)(C3)C(O)=O)cc1 \|r,wU:26.27,wD:33.40,TLB:26:27:34:30.31.32,25:26:34.29.30:32,THB:28:29:32:35.27.26,28:27:34.29.30:32,26:31:34:35.28.27,(-17.57,11.45,;-18.54,10.69,;-19.97,11.26,;-21.18,10.31,;-20.96,8.79,;-19.53,8.21,;-18.32,9.17,;-16.89,8.59,;-15.68,9.54,;-14.25,8.97,;-14.03,7.44,;-15.25,6.49,;-16.67,7.07,;-12.61,6.87,;-11.63,7.62,;-12.39,5.34,;-10.96,4.76,;-10.75,3.24,;-9.32,2.66,;-9.1,1.13,;-10.07,.37,;-7.68,.56,;-7.46,-.97,;-6.03,-1.54,;-4.82,-.59,;-3.39,-1.17,;-2.19,-.22,;-1.2,1.02,;-1.2,2.69,;.12,3.07,;-1,2.05,;-.95,.32,;.56,-.22,;1.56,1.02,;1.56,2.59,;.34,.44,;3.07,1.15,;3.59,2.27,;3.78,.15,;-5.03,.93,;-6.46,1.51,)\|
BDBM50117153	OC(=O)[C@]12CC3CC(C1)[C@H](Oc1ccc(cc1)C(=O)NCCNC(=O)c1ccc4ccccc4c1)C(C3)C2 \|r,wU:3.2,9.10,TLB:1:3:36.35.9:6,10:9:4.8.3:6,THB:37:35:4.8.3:6,37:3:36.35.9:6,9:35:4:8.6.7,9:7:4:36.35.37,(3.58,2.29,;3.07,1.17,;3.79,.17,;1.56,1.02,;1.56,2.59,;.12,3.07,;-1.2,2.69,;-1.2,1.02,;.34,.44,;-2.19,-.22,;-3.39,-1.17,;-4.82,-.59,;-6.03,-1.54,;-7.46,-.97,;-7.68,.56,;-6.46,1.51,;-5.03,.93,;-9.11,1.13,;-9.28,2.35,;-10.32,.17,;-11.75,.75,;-12.96,-.21,;-14.39,.37,;-15.6,-.59,;-15.43,-1.81,;-17.03,-.02,;-17.25,1.51,;-18.69,2.08,;-19.9,1.13,;-21.33,1.7,;-22.54,.75,;-22.32,-.77,;-20.89,-1.35,;-19.68,-.4,;-18.26,-.97,;-.95,.32,;-1,2.05,;.56,-.22,)\|
BDBM223524	OC(=O)C[C@H]1CCC(CC1)c1ccc(NC(=O)CCNC(=O)c2nc(oc2Cl)-c2ccccc2)cc1 \|r,wD:4.3,$;;;;;;;;;;;;;;HN;;;;;HN;;;;;;;;;;;;;;;;$,(10.16,-5.01,;11.5,-4.24,;12.83,-5.01,;11.5,-2.69,;10.16,-1.93,;10.16,-.38,;8.83,.38,;7.5,-.38,;7.5,-1.93,;8.83,-2.69,;6.16,.38,;4.83,-.38,;3.49,.38,;3.49,1.93,;2.16,2.69,;.83,1.93,;.83,.38,;-.51,2.69,;-1.84,1.93,;-3.17,2.69,;-4.51,1.93,;-4.51,.38,;-5.84,2.69,;-7.31,2.22,;-8.21,3.47,;-7.31,4.71,;-5.84,4.24,;-4.51,5.01,;-9.75,3.47,;-10.52,2.13,;-12.06,2.13,;-12.83,3.47,;-12.06,4.8,;-10.52,4.8,;4.83,2.69,;6.16,1.93,)\|
BDBM209541	OC(=O)C[C@H]1CCC(CC1)c1ccc(cc1)-c1ccc2nc(cn2c1)C(=O)NCc1c(F)cccc1F \|r,wD:4.3,(12.04,-5.81,;10.56,-5.01,;10.56,-3.47,;9.26,-5.69,;7.93,-4.92,;7.93,-3.38,;6.59,-2.61,;5.26,-3.38,;5.26,-4.92,;6.59,-5.69,;3.93,-2.61,;2.59,-3.38,;1.26,-2.61,;1.26,-1.07,;2.59,-.3,;3.93,-1.07,;-.08,-.3,;-.08,1.24,;-1.41,2.01,;-2.74,1.24,;-4.21,1.72,;-5.11,.47,;-4.21,-.78,;-2.74,-.3,;-1.41,-1.07,;-6.65,.47,;-7.42,-.86,;-7.42,1.8,;-8.96,1.8,;-9.73,3.14,;-11.27,3.14,;-12.04,1.8,;-12.04,4.47,;-11.27,5.81,;-9.73,5.81,;-8.96,4.47,;-7.42,4.47,)\|
BDBM209542	OC(=O)C[C@H]1CCC(CC1)c1ccc(cc1)-c1ccc2nc(cn2c1)C(=O)NCc1c(Cl)cccc1C(F)(F)F \|r,wD:4.3,(12.04,-5.81,;10.56,-5.01,;10.56,-3.47,;9.26,-5.69,;7.93,-4.92,;7.93,-3.38,;6.59,-2.61,;5.26,-3.38,;5.26,-4.92,;6.59,-5.69,;3.93,-2.61,;2.59,-3.38,;1.26,-2.61,;1.26,-1.07,;2.59,-.3,;3.93,-1.07,;-.08,-.3,;-.08,1.24,;-1.41,2.01,;-2.74,1.24,;-4.21,1.72,;-5.11,.47,;-4.21,-.78,;-2.74,-.3,;-1.41,-1.07,;-6.65,.47,;-7.42,-.86,;-7.42,1.8,;-8.96,1.8,;-9.73,3.14,;-8.96,4.47,;-7.42,4.47,;-9.73,5.81,;-11.27,5.81,;-12.04,4.47,;-11.27,3.14,;-12.04,1.8,;-12.81,.47,;-10.71,1.03,;-13.38,2.57,)\|
BDBM209543	OC(=O)C[C@H]1CCC(CC1)c1ccc(cc1)-c1ccc2nc(cn2c1)C(=O)NCc1ccccc1 \|r,wD:4.3,(11.99,-5.75,;10.65,-4.98,;10.65,-3.44,;9.32,-5.75,;7.98,-4.98,;7.98,-3.44,;6.65,-2.67,;5.32,-3.44,;5.32,-4.98,;6.65,-5.75,;3.98,-2.67,;2.65,-3.44,;1.32,-2.67,;1.32,-1.13,;2.65,-.36,;3.98,-1.13,;-.02,-.36,;-.02,1.18,;-1.35,1.95,;-2.69,1.18,;-4.15,1.66,;-5.06,.41,;-4.15,-.83,;-2.69,-.36,;-1.35,-1.13,;-6.6,.41,;-7.37,-.92,;-7.37,1.75,;-8.91,1.75,;-9.68,3.08,;-8.91,4.41,;-9.68,5.75,;-11.22,5.75,;-11.99,4.41,;-11.22,3.08,)\|
BDBM209544	Cc1ccccc1NC(=O)c1cn2cc(ccc2n1)-c1ccc(cc1)C1CC[C@H](CC(O)=O)CC1 \|r,wD:28.32,(-8.9,5.08,;-9.67,3.75,;-11.21,3.75,;-11.98,2.41,;-11.21,1.08,;-9.67,1.08,;-8.9,2.41,;-7.36,2.41,;-6.59,1.08,;-7.36,-.25,;-5.06,1.08,;-4.15,-.17,;-2.69,.31,;-1.35,-.46,;-.02,.31,;-.02,1.85,;-1.35,2.62,;-2.69,1.85,;-4.15,2.33,;1.32,-.46,;1.32,-2,;2.65,-2.77,;3.98,-2,;3.98,-.46,;2.65,.31,;5.32,-2.77,;6.65,-2,;7.98,-2.77,;7.98,-4.31,;9.32,-5.08,;10.65,-4.31,;11.98,-5.08,;10.65,-2.77,;6.65,-5.08,;5.32,-4.31,)\|
BDBM209545	OC(=O)C[C@H]1CCC(CC1)c1ccc(cc1)-c1ccc2nc(cn2c1)C(=O)Nc1ccc(F)cc1C(F)(F)F \|r,wD:4.3,(12.75,-5.95,;11.42,-5.18,;11.42,-3.64,;10.09,-5.95,;8.75,-5.18,;8.75,-3.64,;7.42,-2.87,;6.09,-3.64,;6.09,-5.18,;7.42,-5.95,;4.75,-2.87,;3.42,-3.64,;2.09,-2.87,;2.09,-1.33,;3.42,-.56,;4.75,-1.33,;.75,-.56,;.75,.98,;-.58,1.75,;-1.92,.98,;-3.38,1.46,;-4.28,.21,;-3.38,-1.03,;-1.92,-.56,;-.58,-1.33,;-5.82,.21,;-6.59,-1.12,;-6.59,1.55,;-8.13,1.55,;-8.9,.21,;-10.44,.21,;-11.21,1.55,;-12.75,1.55,;-10.44,2.88,;-8.83,3.01,;-8.06,4.34,;-7.29,5.67,;-9.4,5.11,;-6.73,3.57,)\|
BDBM209546	OC(=O)C[C@H]1CCC(CC1)c1ccc(cc1)-c1ccc2nc(cn2c1)C(=O)Nc1ccccc1C(F)(F)F \|r,wD:4.3,(11.99,-5.95,;10.65,-5.18,;10.65,-3.64,;9.32,-5.95,;7.98,-5.18,;7.98,-3.64,;6.65,-2.87,;5.32,-3.64,;5.32,-5.18,;6.65,-5.95,;3.98,-2.87,;2.65,-3.64,;1.32,-2.87,;1.32,-1.33,;2.65,-.56,;3.98,-1.33,;-.02,-.56,;-.02,.98,;-1.35,1.75,;-2.69,.98,;-4.15,1.46,;-5.06,.21,;-4.15,-1.03,;-2.69,-.56,;-1.35,-1.33,;-6.6,.21,;-7.37,-1.12,;-7.37,1.55,;-8.91,1.55,;-9.68,.21,;-11.22,.21,;-11.99,1.55,;-11.22,2.88,;-9.6,3.01,;-8.83,4.34,;-8.06,5.67,;-10.17,5.11,;-7.5,3.57,)\|
BDBM209547	OC(=O)C[C@H]1CCC(CC1)c1ccc(cc1)-c1ccc2nc(cn2c1)C(=O)Nc1ccccc1F \|r,wD:4.3,(11.99,-5.08,;10.65,-4.31,;10.65,-2.77,;9.32,-5.08,;7.98,-4.31,;7.98,-2.77,;6.65,-2,;5.32,-2.77,;5.32,-4.31,;6.65,-5.08,;3.98,-2,;2.65,-2.77,;1.32,-2,;1.32,-.46,;2.65,.31,;3.98,-.46,;-.02,.31,;-.02,1.85,;-1.35,2.62,;-2.69,1.85,;-4.15,2.33,;-5.06,1.08,;-4.15,-.17,;-2.69,.31,;-1.35,-.46,;-6.6,1.08,;-7.37,-.25,;-7.37,2.41,;-8.91,2.41,;-9.68,1.08,;-11.22,1.08,;-11.99,2.41,;-11.22,3.75,;-9.68,3.75,;-8.91,5.08,)\|
BDBM209548	COc1ccccc1NC(=O)c1cn2cc(ccc2n1)-c1ccc(cc1)C1CC[C@H](CC(O)=O)CC1 \|r,wD:29.33,(-9.6,5.73,;-8.83,4.39,;-9.6,3.06,;-11.22,2.94,;-11.99,1.6,;-11.22,.27,;-9.68,.27,;-8.91,1.6,;-7.37,1.6,;-6.6,.27,;-7.37,-1.07,;-5.06,.27,;-4.15,-.98,;-2.69,-.5,;-1.35,-1.27,;-.02,-.5,;-.02,1.04,;-1.35,1.81,;-2.69,1.04,;-4.15,1.51,;1.32,-1.27,;1.32,-2.81,;2.65,-3.58,;3.98,-2.81,;3.98,-1.27,;2.65,-.5,;5.32,-3.58,;6.65,-2.81,;7.98,-3.58,;7.98,-5.12,;9.32,-5.89,;10.65,-5.12,;11.99,-5.89,;10.65,-3.58,;6.65,-5.89,;5.32,-5.12,)\|
BDBM209549	Cc1ccccc1CNC(=O)c1cn2cc(ccc2n1)-c1ccc(cc1)C1CC[C@H](CC(O)=O)CC1 \|r,wD:29.33,(-11.99,1.75,;-11.22,3.08,;-11.99,4.41,;-11.22,5.75,;-9.68,5.75,;-8.91,4.41,;-9.68,3.08,;-8.91,1.75,;-7.37,1.75,;-6.6,.41,;-7.37,-.92,;-5.06,.41,;-4.15,-.83,;-2.69,-.36,;-1.35,-1.13,;-.02,-.36,;-.02,1.18,;-1.35,1.95,;-2.69,1.18,;-4.15,1.66,;1.32,-1.13,;1.32,-2.67,;2.65,-3.44,;3.98,-2.67,;3.98,-1.13,;2.65,-.36,;5.32,-3.44,;6.65,-2.67,;7.98,-3.44,;7.98,-4.98,;9.32,-5.75,;10.65,-4.98,;11.99,-5.75,;10.65,-3.44,;6.65,-5.75,;5.32,-4.98,)\|
BDBM209550	Cc1cccc(C)c1NC(=O)c1cn2cc(ccc2n1)-c1ccc(cc1)C1CC[C@H](CC(O)=O)CC1 \|r,wD:29.33,(-8.91,-.25,;-9.68,1.08,;-11.22,1.08,;-11.99,2.41,;-11.22,3.75,;-9.68,3.75,;-8.91,5.08,;-8.91,2.41,;-7.37,2.41,;-6.6,1.08,;-7.37,-.25,;-5.06,1.08,;-4.15,-.17,;-2.69,.31,;-1.35,-.46,;-.02,.31,;-.02,1.85,;-1.35,2.62,;-2.69,1.85,;-4.15,2.33,;1.32,-.46,;1.32,-2,;2.65,-2.77,;3.98,-2,;3.98,-.46,;2.65,.31,;5.32,-2.77,;6.65,-2,;7.98,-2.77,;7.98,-4.31,;9.32,-5.08,;10.65,-4.31,;11.99,-5.08,;10.65,-2.77,;6.65,-5.08,;5.32,-4.31,)\|
BDBM209551	OC(=O)C[C@H]1CCC(CC1)c1ccc(cc1)-c1ccc2nc(cn2c1)C(=O)Nc1cc(F)ccc1F \|r,wD:4.3,(11.99,-5.08,;10.65,-4.31,;10.65,-2.77,;9.32,-5.08,;7.98,-4.31,;7.98,-2.77,;6.65,-2,;5.32,-2.77,;5.32,-4.31,;6.65,-5.08,;3.98,-2,;2.65,-2.77,;1.32,-2,;1.32,-.46,;2.65,.31,;3.98,-.46,;-.02,.31,;-.02,1.85,;-1.35,2.62,;-2.69,1.85,;-4.15,2.33,;-5.06,1.08,;-4.15,-.17,;-2.69,.31,;-1.35,-.46,;-6.6,1.08,;-7.37,-.25,;-7.37,2.41,;-8.91,2.41,;-9.68,1.08,;-11.22,1.08,;-11.99,-.25,;-11.99,2.41,;-11.22,3.75,;-9.68,3.75,;-8.91,5.08,)\|
BDBM209552	OC(=O)C[C@H]1CCC(CC1)c1ccc(cc1)-c1ccc2nc(cn2c1)C(=O)Nc1cc(F)c(F)c(F)c1 \|r,wD:4.3,(12.75,-5.08,;11.42,-4.31,;11.42,-2.77,;10.09,-5.08,;8.75,-4.31,;8.75,-2.77,;7.42,-2,;6.09,-2.77,;6.09,-4.31,;7.42,-5.08,;4.75,-2,;3.42,-2.77,;2.09,-2,;2.09,-.46,;3.42,.31,;4.75,-.46,;.75,.31,;.75,1.85,;-.58,2.62,;-1.92,1.85,;-3.38,2.33,;-4.29,1.08,;-3.38,-.17,;-1.92,.31,;-.58,-.46,;-5.83,1.08,;-6.59,-.25,;-6.59,2.41,;-8.14,2.41,;-8.91,3.75,;-10.45,3.75,;-11.22,5.08,;-11.22,2.41,;-12.75,2.41,;-10.45,1.08,;-11.22,-.25,;-8.91,1.08,)\|
BDBM209553	COc1ccccc1CNC(=O)c1cn2cc(ccc2n1)-c1ccc(cc1)C1CC[C@H](CC(O)=O)CC1 \|r,wD:30.34,(-11.22,.41,;-11.99,1.75,;-11.22,3.08,;-11.99,4.41,;-11.22,5.75,;-9.68,5.75,;-8.91,4.41,;-9.68,3.08,;-8.91,1.75,;-7.37,1.75,;-6.6,.41,;-7.37,-.92,;-5.06,.41,;-4.15,-.83,;-2.69,-.36,;-1.35,-1.13,;-.02,-.36,;-.02,1.18,;-1.35,1.95,;-2.69,1.18,;-4.15,1.66,;1.32,-1.13,;1.32,-2.67,;2.65,-3.44,;3.98,-2.67,;3.98,-1.13,;2.65,-.36,;5.32,-3.44,;6.65,-2.67,;7.98,-3.44,;7.98,-4.98,;9.32,-5.75,;10.65,-4.98,;11.99,-5.75,;10.65,-3.44,;6.65,-5.75,;5.32,-4.98,)\|
BDBM209554	OC(=O)C[C@H]1CCC(CC1)c1ccc(cc1)-c1ccc2nc(cn2c1)C(=O)NCc1c(F)cc(Cl)cc1F \|r,wD:4.3,(11.99,-6.41,;10.65,-5.64,;10.65,-4.1,;9.32,-6.41,;7.98,-5.64,;7.98,-4.1,;6.65,-3.33,;5.32,-4.1,;5.32,-5.64,;6.65,-6.41,;3.98,-3.33,;2.65,-4.1,;1.32,-3.33,;1.32,-1.79,;2.65,-1.02,;3.98,-1.79,;-.02,-1.02,;-.02,.52,;-1.35,1.29,;-2.69,.52,;-4.15,.99,;-5.06,-.25,;-4.15,-1.5,;-2.69,-1.02,;-1.35,-1.79,;-6.6,-.25,;-7.37,-1.59,;-7.37,1.08,;-8.91,1.08,;-9.68,2.41,;-11.22,2.41,;-11.99,1.08,;-11.99,3.75,;-11.22,5.08,;-11.99,6.41,;-9.68,5.08,;-8.91,3.75,;-7.37,3.75,)\|
BDBM209555	Cc1cc(Cl)cc(Cl)c1CNC(=O)c1cn2cc(ccc2n1)-c1ccc(cc1)C1CC[C@H](CC(O)=O)CC1 \|r,wD:31.35,(-7.37,3.75,;-8.91,3.75,;-9.68,5.08,;-11.22,5.08,;-11.99,6.41,;-11.99,3.75,;-11.22,2.41,;-11.99,1.08,;-9.68,2.41,;-8.91,1.08,;-7.37,1.08,;-6.6,-.25,;-7.37,-1.59,;-5.06,-.25,;-4.15,-1.5,;-2.69,-1.02,;-1.35,-1.79,;-.02,-1.02,;-.02,.52,;-1.35,1.29,;-2.69,.52,;-4.15,.99,;1.32,-1.79,;1.32,-3.33,;2.65,-4.1,;3.98,-3.33,;3.98,-1.79,;2.65,-1.02,;5.32,-4.1,;6.65,-3.33,;7.98,-4.1,;7.98,-5.64,;9.32,-6.41,;10.65,-5.64,;11.99,-6.41,;10.65,-4.1,;6.65,-6.41,;5.32,-5.64,)\|
BDBM209556	Cc1cc(C)c(CNC(=O)c2cn3cc(ccc3n2)-c2ccc(cc2)C2CC[C@H](CC(O)=O)CC2)c(C)c1 \|r,wD:28.31,(-11.99,6.41,;-11.22,5.08,;-11.99,3.75,;-11.22,2.41,;-11.99,1.08,;-9.68,2.41,;-8.91,1.08,;-7.37,1.08,;-6.6,-.25,;-7.37,-1.59,;-5.06,-.25,;-4.15,-1.5,;-2.69,-1.02,;-1.35,-1.79,;-.02,-1.02,;-.02,.52,;-1.35,1.29,;-2.69,.52,;-4.15,.99,;1.32,-1.79,;1.32,-3.33,;2.65,-4.1,;3.98,-3.33,;3.98,-1.79,;2.65,-1.02,;5.32,-4.1,;6.65,-3.33,;7.98,-4.1,;7.98,-5.64,;9.32,-6.41,;10.65,-5.64,;11.99,-6.41,;10.65,-4.1,;6.65,-6.41,;5.32,-5.64,;-8.91,3.75,;-7.37,3.75,;-9.68,5.08,)\|
BDBM209557	Cc1ccc(CNC(=O)c2nc3ccc(cn3n2)-c2ccc(cc2)C2CC[C@H](CC(O)=O)CC2)cc1 \|r,wD:27.30,(-11.99,6.41,;-11.22,5.08,;-9.68,5.08,;-8.91,3.75,;-9.68,2.41,;-8.91,1.08,;-7.37,1.08,;-6.6,-.25,;-7.37,-1.59,;-5.06,-.25,;-4.15,.99,;-2.69,.52,;-1.35,1.29,;-.02,.52,;-.02,-1.02,;-1.35,-1.79,;-2.69,-1.02,;-4.15,-1.5,;1.32,-1.79,;1.32,-3.33,;2.65,-4.1,;3.98,-3.33,;3.98,-1.79,;2.65,-1.02,;5.32,-4.1,;6.65,-3.33,;7.98,-4.1,;7.98,-5.64,;9.32,-6.41,;10.65,-5.64,;11.99,-6.41,;10.65,-4.1,;6.65,-6.41,;5.32,-5.64,;-11.22,2.41,;-11.99,3.75,)\|
BDBM209558	CC(C)(C)c1ccc(CNC(=O)c2cn3cc(sc3n2)-c2ccc(cc2)[C@H]2CC[C@H](CC(O)=O)CC2)cc1 \|r,wU:26.28,wD:29.32,(-13.15,-4,;-11.61,-4,;-10.84,-5.33,;-10.07,-4,;-10.84,-2.67,;-11.61,-1.33,;-10.84,,;-9.3,,;-8.53,1.33,;-6.99,1.33,;-6.22,2.67,;-6.99,4,;-4.68,2.67,;-3.77,1.42,;-2.31,1.9,;-.85,1.42,;.06,2.67,;-.85,3.91,;-2.31,3.44,;-3.77,3.91,;1.6,2.67,;2.37,1.33,;3.91,1.33,;4.68,2.67,;3.91,4,;2.37,4,;6.22,2.67,;6.99,4,;8.53,4,;9.3,2.67,;10.84,2.67,;11.61,4,;13.15,4,;10.84,5.33,;8.53,1.33,;6.99,1.33,;-8.53,-1.33,;-9.3,-2.67,)\|
BDBM209559	OC(=O)C[C@H]1CC[C@@H](CC1)c1ccc(cc1)-c1cn2cc(nc2s1)C(=O)Nc1cccc(Cl)c1 \|r,wU:7.10,wD:4.3,(10.07,-.67,;8.53,-.67,;7.76,.67,;7.76,-2,;6.22,-2,;5.45,-.67,;3.91,-.67,;3.14,-2,;3.91,-3.33,;5.45,-3.33,;1.6,-2,;.83,-3.33,;-.71,-3.33,;-1.48,-2,;-.71,-.67,;.83,-.67,;-3.02,-2,;-3.93,-3.25,;-5.39,-2.77,;-6.85,-3.25,;-7.76,-2,;-6.85,-.75,;-5.39,-1.23,;-3.93,-.75,;-9.3,-2,;-10.07,-3.33,;-10.07,-.67,;-9.3,.67,;-10.07,2,;-9.3,3.33,;-7.76,3.33,;-6.99,2,;-5.45,2,;-7.76,.67,)\|
BDBM209560	OC(=O)C[C@H]1CC[C@@H](CC1)c1ccc(cc1)-c1cn2cc(nc2s1)C(=O)NCc1ccc(OC(F)(F)F)c(Cl)c1 \|r,wU:7.10,wD:4.3,(11.19,-2,;9.72,-2,;8.95,-.67,;8.95,-3.33,;7.41,-3.33,;6.64,-2,;5.1,-2,;4.33,-3.33,;5.1,-4.67,;6.64,-4.67,;2.79,-3.33,;2.02,-4.67,;.48,-4.67,;-.29,-3.33,;.48,-2,;2.02,-2,;-1.83,-3.33,;-2.74,-4.58,;-4.2,-4.1,;-5.66,-4.58,;-6.57,-3.33,;-5.66,-2.09,;-4.2,-2.56,;-2.74,-2.09,;-8.11,-3.33,;-8.88,-4.67,;-8.88,-2,;-8.11,-.67,;-8.88,.67,;-10.42,.67,;-11.19,2,;-10.42,3.33,;-11.19,4.67,;-10.42,6,;-9.65,7.34,;-11.75,6.77,;-8.88,6,;-8.88,3.33,;-8.11,4.67,;-8.11,2,)\|
BDBM209561	OC(=O)C[C@H]1CC[C@@H](CC1)c1ccc(cc1)-c1cn2cc(nc2s1)C(=O)NCc1ccc(F)c(Cl)c1 \|r,wU:7.10,wD:4.3,(11.19,-2,;9.72,-2,;8.95,-.67,;8.95,-3.33,;7.41,-3.33,;6.64,-2,;5.1,-2,;4.33,-3.33,;5.1,-4.67,;6.64,-4.67,;2.79,-3.33,;2.02,-4.67,;.48,-4.67,;-.29,-3.33,;.48,-2,;2.02,-2,;-1.83,-3.33,;-2.74,-4.58,;-4.2,-4.1,;-5.66,-4.58,;-6.57,-3.33,;-5.66,-2.09,;-4.2,-2.56,;-2.74,-2.09,;-8.11,-3.33,;-8.88,-4.67,;-8.88,-2,;-8.11,-.67,;-8.88,.67,;-10.42,.67,;-11.19,2,;-10.42,3.33,;-11.19,4.67,;-8.88,3.33,;-8.11,4.67,;-8.11,2,)\|
BDBM209562	OC(=O)C[C@H]1CC[C@@H](CC1)c1ccc(cc1)-c1cn2cc(nc2s1)C(=O)NCc1cccc(OC(F)(F)F)c1 \|r,wU:7.10,wD:4.3,(11.96,-1.33,;10.49,-1.33,;9.72,,;9.72,-2.67,;8.18,-2.67,;7.41,-1.33,;5.87,-1.33,;5.1,-2.67,;5.87,-4,;7.41,-4,;3.56,-2.67,;2.79,-4,;1.25,-4,;.48,-2.67,;1.25,-1.33,;2.79,-1.33,;-1.06,-2.67,;-1.97,-3.91,;-3.43,-3.44,;-4.89,-3.91,;-5.8,-2.67,;-4.89,-1.42,;-3.43,-1.9,;-1.97,-1.42,;-7.34,-2.67,;-8.11,-4,;-8.11,-1.33,;-7.34,,;-8.11,1.33,;-7.34,2.67,;-8.11,4,;-9.65,4,;-10.42,2.67,;-11.96,2.67,;-13.05,1.58,;-14.14,.49,;-11.96,.49,;-13.82,2.91,;-9.65,1.33,)\|
BDBM209563	OC(=O)C[C@H]1CC[C@@H](CC1)c1ccc(cc1)-c1cn2cc(nc2s1)C(=O)NCc1cc(OC(F)(F)F)ccc1F \|r,wU:7.10,wD:4.3,(11.96,-1.33,;10.49,-1.33,;9.72,,;9.72,-2.67,;8.18,-2.67,;7.41,-1.33,;5.87,-1.33,;5.1,-2.67,;5.87,-4,;7.41,-4,;3.56,-2.67,;2.79,-4,;1.25,-4,;.48,-2.67,;1.25,-1.33,;2.79,-1.33,;-1.06,-2.67,;-1.97,-3.91,;-3.43,-3.44,;-4.89,-3.91,;-5.8,-2.67,;-4.89,-1.42,;-3.43,-1.9,;-1.97,-1.42,;-7.34,-2.67,;-8.11,-4,;-8.11,-1.33,;-7.34,,;-8.11,1.33,;-9.65,1.33,;-10.42,2.67,;-11.96,2.67,;-13.05,1.58,;-14.14,.49,;-11.96,.49,;-13.82,2.91,;-9.65,4,;-8.11,4,;-7.34,2.67,;-5.8,2.67,)\|
BDBM209564	OC(=O)C[C@H]1CC[C@@H](CC1)c1ccc(cc1)-c1cn2cc(nc2s1)C(=O)Nc1cccc(OC(F)(F)F)c1 \|r,wU:7.10,wD:4.3,(12.35,2,;10.88,2,;10.11,3.33,;10.11,.67,;8.57,.67,;7.8,2,;6.26,2,;5.49,.67,;6.26,-.67,;7.8,-.67,;3.95,.67,;3.18,-.67,;1.64,-.67,;.87,.67,;1.64,2,;3.18,2,;-.67,.67,;-1.58,-.58,;-3.05,-.1,;-4.51,-.58,;-5.41,.67,;-4.51,1.91,;-3.05,1.44,;-1.58,1.91,;-6.96,.67,;-7.73,2,;-7.73,-.67,;-9.27,-.67,;-10.04,.67,;-11.58,.67,;-12.35,-.67,;-11.58,-2,;-12.35,-3.33,;-13.89,-3.33,;-15.43,-3.33,;-13.89,-4.87,;-13.49,-1.85,;-10.04,-2,)\|
BDBM209565	CC(C)c1ccc(CNC(=O)c2cn3cc(sc3n2)-c2ccc(cc2)C2CC[C@H](CC(O)=O)CC2)cc1 \|r,wD:28.31,(-10.84,-5.33,;-11.61,-4,;-13.15,-4,;-10.84,-2.67,;-9.3,-2.67,;-8.53,-1.33,;-9.3,,;-8.53,1.33,;-6.99,1.33,;-6.22,2.67,;-6.99,4,;-4.68,2.67,;-3.77,1.42,;-2.31,1.9,;-.85,1.42,;.06,2.67,;-.85,3.91,;-2.31,3.44,;-3.77,3.91,;1.6,2.67,;2.37,1.33,;3.91,1.33,;4.68,2.67,;3.91,4,;2.37,4,;6.22,2.67,;6.99,4,;8.53,4,;9.3,2.67,;10.84,2.67,;11.61,4,;13.15,4,;10.84,5.33,;8.53,1.33,;6.99,1.33,;-10.84,,;-11.61,-1.33,)\|
BDBM209566	OC(=O)C[C@H]1CCC(CC1)c1ccc(cc1)-c1cn2cc(nc2s1)C(=O)NC1(CC1)c1cc(F)ccc1F \|r,wD:4.3,(11.61,2.67,;10.07,2.67,;9.3,4,;9.3,1.33,;7.76,1.33,;6.99,2.67,;5.45,2.67,;4.68,1.33,;5.45,,;6.99,,;3.14,1.33,;2.37,,;.83,,;.06,1.33,;.83,2.67,;2.37,2.67,;-1.48,1.33,;-2.39,.09,;-3.85,.56,;-5.31,.09,;-6.22,1.33,;-5.31,2.58,;-3.85,2.1,;-2.39,2.58,;-7.76,1.33,;-8.53,2.67,;-8.53,,;-10.07,,;-10.84,1.33,;-11.61,,;-9.3,-1.33,;-7.76,-1.33,;-6.99,-2.67,;-5.45,-2.67,;-7.76,-4,;-9.3,-4,;-10.07,-2.67,;-11.61,-2.67,)\|
BDBM209567	COc1ccc(OC(F)(F)F)cc1CNC(=O)c1cn2cc(sc2n1)-c1ccc(cc1)C1CC[C@H](CC(O)=O)CC1 \|r,wD:34.38,(-11.98,3.03,;-12.38,1.55,;-11.61,.21,;-12.38,-1.12,;-11.61,-2.45,;-10.04,-2.5,;-9.27,-3.84,;-7.73,-3.84,;-6.19,-3.84,;-7.73,-5.38,;-7.73,-2.3,;-9.3,-1.12,;-10.07,.21,;-9.3,1.55,;-7.76,1.55,;-6.99,2.88,;-7.76,4.21,;-5.45,2.88,;-4.54,1.63,;-3.08,2.11,;-1.62,1.63,;-.71,2.88,;-1.62,4.13,;-3.08,3.65,;-4.54,4.13,;.83,2.88,;1.6,1.55,;3.14,1.55,;3.91,2.88,;3.14,4.21,;1.6,4.21,;5.45,2.88,;6.22,4.21,;7.76,4.21,;8.53,2.88,;10.07,2.88,;10.84,4.21,;12.38,4.21,;10.07,5.55,;7.76,1.55,;6.22,1.55,)\|
BDBM209568	OC(=O)C[C@H]1CCC(CC1)c1ccc(cc1)-c1cn2cc(nc2s1)C(=O)NCc1ccc(OC(F)(F)F)cc1 \|r,wD:4.3,(12.38,3.33,;10.84,3.33,;10.07,4.67,;10.07,2,;8.53,2,;7.76,3.33,;6.22,3.33,;5.45,2,;6.22,.67,;7.76,.67,;3.91,2,;3.14,.67,;1.6,.67,;.83,2,;1.6,3.33,;3.14,3.33,;-.71,2,;-1.62,.75,;-3.08,1.23,;-4.54,.75,;-5.45,2,;-4.54,3.25,;-3.08,2.77,;-1.62,3.25,;-6.99,2,;-7.76,3.33,;-7.76,.67,;-9.3,.67,;-10.07,-.67,;-9.3,-2,;-10.07,-3.33,;-11.61,-3.33,;-12.38,-4.67,;-13.87,-5.07,;-15.35,-5.47,;-13.47,-6.55,;-13.87,-3.53,;-12.38,-2,;-11.61,-.67,)\|
BDBM209569	COc1ccc(CNC(=O)c2cn3cc(sc3n2)-c2ccc(cc2)C2CC[C@H](CC(O)=O)CC2)cc1 \|r,wD:27.30,(-12.76,4.67,;-11.22,4.67,;-10.45,3.33,;-8.91,3.33,;-8.14,2,;-8.91,.67,;-8.14,-.67,;-8.91,-2,;-8.14,-3.33,;-8.91,-4.67,;-6.6,-3.33,;-5.7,-4.58,;-4.24,-4.1,;-2.77,-4.58,;-1.87,-3.33,;-2.77,-2.09,;-4.24,-2.56,;-5.7,-2.09,;-.33,-3.33,;.44,-2,;1.98,-2,;2.75,-3.33,;1.98,-4.67,;.44,-4.67,;4.29,-3.33,;5.06,-2,;6.6,-2,;7.37,-3.33,;8.91,-3.33,;9.68,-2,;11.22,-2,;8.91,-.67,;6.6,-4.67,;5.06,-4.67,;-10.45,.67,;-11.22,2,)\|
BDBM209570	OC(=O)C[C@H]1CCC(CC1)c1ccc(cc1)-c1cn2cc(nc2s1)C(=O)NCc1ccc2OCOc2c1 \|r,wD:4.3,(12.06,-1.91,;10.52,-1.91,;9.75,-.57,;9.75,-3.24,;8.21,-3.24,;7.44,-1.91,;5.9,-1.91,;5.13,-3.24,;5.9,-4.57,;7.44,-4.57,;3.59,-3.24,;2.82,-1.91,;1.28,-1.91,;.51,-3.24,;1.28,-4.57,;2.82,-4.57,;-1.03,-3.24,;-1.94,-4.49,;-3.4,-4.01,;-4.87,-4.49,;-5.77,-3.24,;-4.87,-1.99,;-3.4,-2.47,;-1.94,-1.99,;-7.31,-3.24,;-8.08,-4.57,;-8.08,-1.91,;-7.31,-.57,;-8.08,.76,;-7.31,2.09,;-8.08,3.43,;-9.62,3.43,;-10.65,4.57,;-12.06,3.95,;-11.9,2.42,;-10.39,2.09,;-9.62,.76,)\|
BDBM209571	OC(=O)C[C@H]1CCC(CC1)c1ccc(cc1)-c1cn2cc(nc2s1)C(=O)NCc1ccc(F)c(OC(F)(F)F)c1 \|r,wD:4.3,(11.23,-3.53,;9.69,-3.53,;8.92,-2.19,;8.92,-4.86,;7.38,-4.86,;6.6,-3.53,;5.06,-3.53,;4.29,-4.86,;5.06,-6.19,;6.6,-6.19,;2.75,-4.86,;1.99,-3.53,;.44,-3.53,;-.33,-4.86,;.44,-6.19,;1.99,-6.19,;-1.87,-4.86,;-2.77,-6.11,;-4.24,-5.63,;-5.7,-6.11,;-6.6,-4.86,;-5.7,-3.61,;-4.24,-4.09,;-2.77,-3.61,;-8.14,-4.86,;-8.92,-6.19,;-8.92,-3.53,;-8.14,-2.19,;-8.92,-.86,;-10.46,-.86,;-11.23,.48,;-10.46,1.81,;-11.23,3.14,;-8.89,1.86,;-8.12,3.19,;-6.58,3.19,;-5.04,3.19,;-6.58,1.65,;-6.58,4.73,;-8.14,.48,)\|
BDBM209572	OC(=O)C[C@H]1CCC(CC1)c1ccc(cc1)-c1cn2cc(nc2s1)C(=O)Nc1ccc(F)c(Cl)c1 \|r,wD:4.3,(10.07,-1.33,;8.53,-1.33,;7.76,,;7.76,-2.67,;6.22,-2.67,;5.45,-1.33,;3.91,-1.33,;3.14,-2.67,;3.91,-4,;5.45,-4,;1.6,-2.67,;.83,-4,;-.71,-4,;-1.48,-2.67,;-.71,-1.33,;.83,-1.33,;-3.02,-2.67,;-3.93,-3.91,;-5.39,-3.44,;-6.85,-3.91,;-7.76,-2.67,;-6.85,-1.42,;-5.39,-1.9,;-3.93,-1.42,;-9.3,-2.67,;-10.07,-4,;-10.07,-1.33,;-9.3,,;-7.76,,;-6.99,1.33,;-7.76,2.67,;-6.99,4,;-9.3,2.67,;-10.07,4,;-10.07,1.33,)\|
BDBM209573	OC(=O)C[C@H]1CC[C@@H](CC1)c1ccc(cc1)-c1cn2cc(nc2s1)C(=O)NCc1c(Cl)cccc1Cl \|r,wU:7.10,wD:4.3,(12.38,2.67,;10.84,2.67,;10.07,4,;10.07,1.33,;8.53,1.33,;7.76,2.67,;6.22,2.67,;5.45,1.33,;6.22,,;7.76,,;3.91,1.33,;3.14,2.67,;1.6,2.67,;.83,1.33,;1.6,,;3.14,,;-.71,1.33,;-1.62,.09,;-3.08,.56,;-4.54,.09,;-5.45,1.33,;-4.54,2.58,;-3.08,2.1,;-1.62,2.58,;-6.99,1.33,;-7.76,2.67,;-7.76,,;-9.3,,;-10.07,-1.33,;-11.61,-1.33,;-12.38,,;-12.38,-2.67,;-11.61,-4,;-10.07,-4,;-9.3,-2.67,;-7.76,-2.67,)\|
BDBM209574	OC(=O)C[C@H]1CC[C@@H](CC1)c1ccc(cc1)-c1cn2cc(nc2s1)C(=O)NCc1c(F)cccc1Cl \|r,wU:7.10,wD:4.3,(12.38,2.67,;10.84,2.67,;10.07,4,;10.07,1.33,;8.53,1.33,;7.76,2.67,;6.22,2.67,;5.45,1.33,;6.22,,;7.76,,;3.91,1.33,;3.14,2.67,;1.6,2.67,;.83,1.33,;1.6,,;3.14,,;-.71,1.33,;-1.62,.09,;-3.08,.56,;-4.54,.09,;-5.45,1.33,;-4.54,2.58,;-3.08,2.1,;-1.62,2.58,;-6.99,1.33,;-7.76,2.67,;-7.76,,;-9.3,,;-10.07,-1.33,;-11.61,-1.33,;-12.38,,;-12.38,-2.67,;-11.61,-4,;-10.07,-4,;-9.3,-2.67,;-7.76,-2.67,)\|
BDBM209575	OC(=O)C[C@H]1CC[C@@H](CC1)c1ccc(cc1)-c1cn2cc(nc2s1)C(=O)NCc1c(F)cccc1F \|r,wU:7.10,wD:4.3,(12.38,2.67,;10.84,2.67,;10.07,4,;10.07,1.33,;8.53,1.33,;7.76,2.67,;6.22,2.67,;5.45,1.33,;6.22,,;7.76,,;3.91,1.33,;3.14,2.67,;1.6,2.67,;.83,1.33,;1.6,,;3.14,,;-.71,1.33,;-1.62,.09,;-3.08,.56,;-4.54,.09,;-5.45,1.33,;-4.54,2.58,;-3.08,2.1,;-1.62,2.58,;-6.99,1.33,;-7.76,2.67,;-7.76,,;-9.3,,;-10.07,-1.33,;-11.61,-1.33,;-12.38,,;-12.38,-2.67,;-11.61,-4,;-10.07,-4,;-9.3,-2.67,;-7.76,-2.67,)\|
BDBM209576	OC(=O)C[C@H]1CC[C@@H](CC1)c1ccc(cc1)-c1cn2cc(nc2s1)C(=O)NCc1c(F)cc(Cl)cc1F \|r,wU:7.10,wD:4.3,(12.38,3.33,;10.84,3.33,;10.07,4.67,;10.07,2,;8.53,2,;7.76,3.33,;6.22,3.33,;5.45,2,;6.22,.67,;7.76,.67,;3.91,2,;3.14,3.33,;1.6,3.33,;.83,2,;1.6,.67,;3.14,.67,;-.71,2,;-1.62,.75,;-3.08,1.23,;-4.54,.75,;-5.45,2,;-4.54,3.25,;-3.08,2.77,;-1.62,3.25,;-6.99,2,;-7.76,3.33,;-7.76,.67,;-9.3,.67,;-10.07,-.67,;-11.61,-.67,;-12.38,.67,;-12.38,-2,;-11.61,-3.33,;-12.38,-4.67,;-10.07,-3.33,;-9.3,-2,;-7.76,-2,)\|
BDBM209513	OC(=O)C[C@H]1CCC(CC1)c1ccc(cc1)-c1ccc2nc(cn2c1)C(=O)NCc1ccc(OC(F)(F)F)cc1 \|r,wD:4.3,(11.99,-6.41,;10.65,-5.64,;10.65,-4.1,;9.32,-6.41,;7.98,-5.64,;7.98,-4.1,;6.65,-3.33,;5.32,-4.1,;5.32,-5.64,;6.65,-6.41,;3.98,-3.33,;2.65,-4.1,;1.32,-3.33,;1.32,-1.79,;2.65,-1.02,;3.98,-1.79,;-.02,-1.02,;-.02,.52,;-1.35,1.29,;-2.69,.52,;-4.15,.99,;-5.06,-.25,;-4.15,-1.5,;-2.69,-1.02,;-1.35,-1.79,;-6.59,-.25,;-7.37,-1.59,;-7.37,1.08,;-8.91,1.08,;-9.67,2.41,;-11.22,2.41,;-11.99,3.75,;-11.22,5.08,;-11.99,6.41,;-11.59,7.9,;-11.19,9.39,;-10.25,7.13,;-13.13,7.9,;-9.67,5.08,;-8.91,3.75,)\|
BDBM209514	OC(=O)C[C@H]1CCC(CC1)c1ccc(cc1)-c1ccc2nc(cn2c1)C(=O)Nc1ccc(cc1)C(F)(F)F \|r,wD:4.3,(12.76,-3.85,;11.42,-3.08,;11.42,-1.54,;10.09,-3.85,;8.75,-3.08,;8.75,-1.54,;7.42,-.77,;6.09,-1.54,;6.09,-3.08,;7.42,-3.85,;4.75,-.77,;3.42,-1.54,;2.09,-.77,;2.09,.77,;3.42,1.54,;4.75,.77,;.75,1.54,;.75,3.08,;-.58,3.85,;-1.92,3.08,;-3.38,3.56,;-4.29,2.31,;-3.38,1.06,;-1.92,1.54,;-.58,.77,;-5.83,2.31,;-6.6,3.64,;-6.6,.98,;-8.14,.98,;-8.91,2.31,;-10.45,2.31,;-11.22,.98,;-10.45,-.36,;-8.91,-.36,;-12.76,.98,;-14.3,.98,;-12.76,-.56,;-12.76,2.52,)\|
BDBM209515	OC(=O)C[C@H]1CCC(CC1)c1ccc(cc1)-c1ccc2nc(cn2c1)C(=O)Nc1ccc(OC(F)(F)F)cc1 \|r,wD:4.3,(9.01,4.57,;7.67,3.8,;6.34,4.57,;7.67,2.26,;6.34,1.49,;5.01,2.26,;3.67,1.49,;3.67,-.05,;5.01,-.82,;6.34,-.05,;2.34,-.82,;2.34,-2.36,;1.01,-3.13,;-.33,-2.36,;-.33,-.82,;1.01,-.05,;-1.66,-3.13,;-1.66,-4.67,;-2.99,-5.44,;-4.33,-4.67,;-5.79,-5.14,;-6.7,-3.9,;-5.79,-2.65,;-4.33,-3.13,;-2.99,-2.36,;-8.24,-3.9,;-9.01,-5.23,;-9.01,-2.56,;-8.24,-1.23,;-6.7,-1.23,;-5.93,.1,;-6.67,1.48,;-5.9,2.82,;-6.67,4.15,;-7.44,5.49,;-5.34,4.92,;-8,3.38,;-8.24,1.44,;-9.01,.1,)\|
BDBM209516	OC(=O)C[C@H]1CCC(CC1)c1ccc(cc1)-c1ccc2nc(cn2c1)C(=O)NCc1ccc(cc1)C(F)(F)F \|r,wD:4.3,(11.32,5.01,;9.98,4.24,;8.65,5.01,;9.98,2.69,;8.65,1.93,;7.32,2.69,;5.98,1.93,;5.98,.39,;7.32,-.39,;8.65,.39,;4.65,-.39,;4.65,-1.93,;3.32,-2.69,;1.98,-1.93,;1.98,-.39,;3.32,.39,;.65,-2.69,;.65,-4.24,;-.68,-5.01,;-2.02,-4.24,;-3.48,-4.71,;-4.39,-3.47,;-3.48,-2.22,;-2.02,-2.69,;-.68,-1.93,;-5.93,-3.47,;-6.7,-4.8,;-6.7,-2.13,;-8.24,-2.13,;-9.01,-.8,;-8.24,.54,;-9.01,1.87,;-10.55,1.87,;-11.32,.54,;-10.55,-.8,;-11.32,3.2,;-12.09,4.54,;-12.81,2.8,;-10.23,4.29,)\|
BDBM209577	CC(C)([C@H]1CCC(CC1)c1ccc(cc1)-c1ccc2nc(cn2c1)C(=O)NCc1ccccc1)C(O)=O \|r,wD:3.2,(8.55,-6.41,;9.32,-5.08,;10.09,-6.41,;7.98,-4.31,;7.98,-2.77,;6.65,-2,;5.32,-2.77,;5.32,-4.31,;6.65,-5.08,;3.98,-2,;2.65,-2.77,;1.32,-2,;1.32,-.46,;2.65,.31,;3.98,-.46,;-.02,.31,;-.02,1.85,;-1.35,2.62,;-2.69,1.85,;-4.15,2.33,;-5.06,1.08,;-4.15,-.17,;-2.69,.31,;-1.35,-.46,;-6.6,1.08,;-7.37,-.25,;-7.37,2.41,;-8.91,2.41,;-9.68,3.75,;-8.91,5.08,;-9.68,6.41,;-11.22,6.41,;-11.99,5.08,;-11.22,3.75,;10.65,-4.31,;11.99,-5.08,;10.65,-2.77,)\|
BDBM209578	CC(C)([C@H]1CCC(CC1)c1ccc(cc1)-c1ccc2nc(cn2c1)C(=O)NCc1ccc(OC(F)(F)F)cc1)C(O)=O \|r,wD:3.2,(8.55,-7.08,;9.32,-5.75,;10.09,-7.08,;7.98,-4.98,;7.98,-3.44,;6.65,-2.67,;5.32,-3.44,;5.32,-4.98,;6.65,-5.75,;3.98,-2.67,;2.65,-3.44,;1.32,-2.67,;1.32,-1.13,;2.65,-.36,;3.98,-1.13,;-.02,-.36,;-.02,1.18,;-1.35,1.95,;-2.69,1.18,;-4.15,1.66,;-5.06,.41,;-4.15,-.83,;-2.69,-.36,;-1.35,-1.13,;-6.59,.41,;-7.37,-.92,;-7.37,1.75,;-8.91,1.75,;-9.67,3.08,;-11.22,3.08,;-11.99,4.41,;-11.22,5.75,;-11.99,7.08,;-13.53,7.08,;-15.07,7.08,;-13.53,5.54,;-13.53,8.62,;-9.67,5.75,;-8.91,4.41,;10.65,-4.98,;11.99,-5.75,;10.65,-3.44,)\|
BDBM209579	Cc1cccc(Cl)c1CNC(=O)c1cn2cc(ccc2n1)-c1ccc(cc1)C1CC[C@@H](CC1)C(C)(C)C(O)=O \|r,wD:30.37,(-7.37,5.08,;-8.91,5.08,;-9.68,6.41,;-11.22,6.41,;-11.99,5.08,;-11.22,3.75,;-11.99,2.41,;-9.68,3.75,;-8.91,2.41,;-7.37,2.41,;-6.6,1.08,;-7.37,-.25,;-5.06,1.08,;-4.15,-.17,;-2.69,.31,;-1.35,-.46,;-.02,.31,;-.02,1.85,;-1.35,2.62,;-2.69,1.85,;-4.15,2.33,;1.32,-.46,;1.32,-2,;2.65,-2.77,;3.98,-2,;3.98,-.46,;2.65,.31,;5.32,-2.77,;6.65,-2,;7.98,-2.77,;7.98,-4.31,;6.65,-5.08,;5.32,-4.31,;9.32,-5.08,;8.55,-6.41,;10.09,-6.41,;10.65,-4.31,;11.99,-5.08,;10.65,-2.77,)\|
BDBM209517	OC(=O)C[C@H]1CCC(CC1)c1ccc(cc1)-c1ccc2nc(cn2c1)C(=O)Nc1cccc(OC(F)(F)F)c1 \|r,wD:4.3,(11.99,-3.85,;10.65,-3.08,;10.65,-1.54,;9.32,-3.85,;7.98,-3.08,;7.98,-1.54,;6.65,-.77,;5.32,-1.54,;5.32,-3.08,;6.65,-3.85,;3.98,-.77,;2.65,-1.54,;1.32,-.77,;1.32,.77,;2.65,1.54,;3.98,.77,;-.02,1.54,;-.02,3.08,;-1.35,3.85,;-2.69,3.08,;-4.15,3.56,;-5.06,2.31,;-4.15,1.06,;-2.69,1.54,;-1.35,.77,;-6.59,2.31,;-7.37,3.64,;-7.37,.98,;-8.91,.98,;-9.67,2.31,;-11.22,2.31,;-11.99,.98,;-11.22,-.36,;-11.99,-1.69,;-11.22,-3.02,;-10.45,-4.36,;-9.88,-2.25,;-12.55,-3.79,;-9.67,-.36,)\|
BDBM209518	OC(=O)C[C@H]1CCC(CC1)c1ccc(cc1)-c1ccc2nc(cn2c1)C(=O)Nc1cccc(c1)C(F)(F)F \|r,wD:4.3,(11.99,-3.85,;10.65,-3.08,;10.65,-1.54,;9.32,-3.85,;7.98,-3.08,;7.98,-1.54,;6.65,-.77,;5.32,-1.54,;5.32,-3.08,;6.65,-3.85,;3.98,-.77,;2.65,-1.54,;1.32,-.77,;1.32,.77,;2.65,1.54,;3.98,.77,;-.02,1.54,;-.02,3.08,;-1.35,3.85,;-2.69,3.08,;-4.15,3.56,;-5.06,2.31,;-4.15,1.06,;-2.69,1.54,;-1.35,.77,;-6.59,2.31,;-7.37,3.64,;-7.37,.98,;-8.91,.98,;-9.67,2.31,;-11.22,2.31,;-11.99,.98,;-11.22,-.36,;-9.67,-.36,;-11.99,-1.69,;-12.76,-3.02,;-10.65,-2.46,;-13.32,-.92,)\|
BDBM209519	OC(=O)C[C@H]1CCC(CC1)c1ccc(cc1)-c1ccc2nc(cn2c1)C(=O)NCc1cccc(OC(F)(F)F)c1 \|r,wD:4.3,(11.98,-8.06,;10.65,-7.29,;10.65,-5.75,;9.32,-8.06,;7.98,-7.29,;7.98,-5.75,;6.65,-4.98,;5.32,-5.75,;5.32,-7.29,;6.65,-8.06,;3.98,-4.98,;2.65,-5.75,;1.32,-4.98,;1.32,-3.44,;2.65,-2.67,;3.98,-3.44,;-.02,-2.67,;-.02,-1.13,;-1.35,-.36,;-2.69,-1.13,;-4.15,-.65,;-5.05,-1.9,;-4.15,-3.14,;-2.69,-2.67,;-1.35,-3.44,;-6.6,-1.9,;-7.36,-3.23,;-7.36,-.56,;-8.9,-.56,;-9.67,.77,;-11.21,.77,;-11.98,2.11,;-11.21,3.44,;-9.65,3.49,;-8.88,4.82,;-9.65,6.15,;-10.42,7.49,;-8.31,6.92,;-10.98,5.38,;-8.9,2.11,)\|
BDBM209520	CC(C)(C)c1ccc(CNC(=O)c2cn3cc(ccc3n2)-c2ccc(cc2)C2CC[C@H](CC(O)=O)CC2)cc1 \|r,wD:30.33,(-10.45,7.08,;-11.22,5.75,;-12.76,5.75,;-9.68,5.75,;-10.45,4.41,;-11.22,3.08,;-10.45,1.75,;-8.91,1.75,;-8.14,.41,;-6.6,.41,;-5.83,-.92,;-6.6,-2.25,;-4.29,-.92,;-3.38,-2.17,;-1.92,-1.69,;-.58,-2.46,;.75,-1.69,;.75,-.15,;-.58,.62,;-1.92,-.15,;-3.38,.32,;2.09,-2.46,;2.09,-4,;3.42,-4.77,;4.75,-4,;4.75,-2.46,;3.42,-1.69,;6.09,-4.77,;7.42,-4,;8.75,-4.77,;8.75,-6.31,;10.09,-7.08,;11.42,-6.31,;12.76,-7.08,;11.42,-4.77,;7.42,-7.08,;6.09,-6.31,;-8.14,3.08,;-8.91,4.41,)\|
BDBM209521	OC(=O)C[C@H]1CCC(CC1)c1ccc(cc1)-c1ccc2nc(cn2c1)C(=O)NCc1cc(OC(F)(F)F)ccc1F \|r,wD:4.3,(12.85,-5.75,;11.51,-4.98,;11.51,-3.44,;10.18,-5.75,;8.84,-4.98,;8.84,-3.44,;7.51,-2.67,;6.18,-3.44,;6.18,-4.98,;7.51,-5.75,;4.84,-2.67,;3.51,-3.44,;2.18,-2.67,;2.18,-1.13,;3.51,-.36,;4.84,-1.13,;.84,-.36,;.84,1.18,;-.49,1.95,;-1.83,1.18,;-3.29,1.66,;-4.19,.41,;-3.29,-.83,;-1.83,-.36,;-.49,-1.13,;-5.77,.41,;-6.54,-.92,;-6.54,1.75,;-8.15,1.75,;-8.92,3.08,;-10.46,3.08,;-11.23,4.41,;-12.85,4.41,;-13.62,3.08,;-14.39,1.75,;-14.95,3.85,;-12.28,2.31,;-10.46,5.75,;-8.92,5.75,;-8.15,4.41,;-6.61,4.41,)\|
BDBM209522	OC(=O)C[C@H]1CCC(CC1)c1ccc(cc1)-c1ccc2nc(cn2c1)C(=O)NCc1ccc(F)c(OC(F)(F)F)c1 \|r,wD:4.3,(12.85,-6.41,;11.51,-5.64,;11.51,-4.1,;10.18,-6.41,;8.84,-5.64,;8.84,-4.1,;7.51,-3.33,;6.18,-4.1,;6.18,-5.64,;7.51,-6.41,;4.84,-3.33,;3.51,-4.1,;2.18,-3.33,;2.18,-1.79,;3.51,-1.02,;4.84,-1.79,;.84,-1.02,;.84,.52,;-.49,1.29,;-1.83,.52,;-3.29,.99,;-4.19,-.25,;-3.29,-1.5,;-1.83,-1.02,;-.49,-1.79,;-5.77,-.25,;-6.54,-1.59,;-6.54,1.08,;-8.15,1.08,;-8.92,2.41,;-8.15,3.75,;-8.92,5.08,;-10.46,5.08,;-11.23,6.41,;-11.23,3.75,;-12.85,3.75,;-13.62,2.41,;-14.39,1.08,;-14.95,3.18,;-12.28,1.64,;-10.46,2.41,)\|
BDBM209523	OC(=O)C[C@H]1CCC(CC1)c1ccc(cc1)-c1ccc2nc(cn2c1)C(=O)NCc1ccc(c(F)c1)C(F)(F)F \|r,wD:4.3,(12.76,-6.41,;11.42,-5.64,;11.42,-4.1,;10.09,-6.41,;8.75,-5.64,;8.75,-4.1,;7.42,-3.33,;6.09,-4.1,;6.09,-5.64,;7.42,-6.41,;4.75,-3.33,;3.42,-4.1,;2.09,-3.33,;2.09,-1.79,;3.42,-1.02,;4.75,-1.79,;.75,-1.02,;.75,.52,;-.58,1.29,;-1.92,.52,;-3.38,.99,;-4.29,-.25,;-3.38,-1.5,;-1.92,-1.02,;-.58,-1.79,;-5.83,-.25,;-6.6,-1.59,;-6.6,1.08,;-8.14,1.08,;-8.91,2.41,;-8.14,3.75,;-8.91,5.08,;-10.45,5.08,;-11.22,3.75,;-12.76,3.75,;-10.45,2.41,;-11.22,6.41,;-10.45,7.75,;-11.99,5.08,;-12.55,7.18,)\|
BDBM209524	COc1ccc(CNC(=O)c2cn3cc(ccc3n2)-c2ccc(cc2)C2CC[C@H](CC(O)=O)CC2)cc1 \|r,wD:28.31,(-11.22,7.75,;-11.99,6.41,;-11.22,5.08,;-11.99,3.75,;-11.22,2.41,;-9.68,2.41,;-8.91,1.08,;-7.37,1.08,;-6.6,-.25,;-7.37,-1.59,;-5.06,-.25,;-4.15,-1.5,;-2.69,-1.02,;-1.35,-1.79,;-.02,-1.02,;-.02,.52,;-1.35,1.29,;-2.69,.52,;-4.15,.99,;1.32,-1.79,;1.32,-3.33,;2.65,-4.1,;3.98,-3.33,;3.98,-1.79,;2.65,-1.02,;5.32,-4.1,;6.65,-3.33,;7.98,-4.1,;7.98,-5.64,;9.32,-6.41,;10.65,-5.64,;11.99,-6.41,;10.65,-4.1,;6.65,-6.41,;5.32,-5.64,;-8.91,3.75,;-9.68,5.08,)\|
BDBM209525	OC(=O)C[C@H]1CCC(CC1)c1ccc(cc1)-c1ccc2nc(cn2c1)C(=O)Nc1ccc(F)c(Cl)c1 \|r,wD:4.3,(9.67,-6.41,;8.34,-5.64,;8.34,-4.1,;7.01,-6.41,;5.67,-5.64,;5.67,-4.1,;4.34,-3.33,;3.01,-4.1,;3.01,-5.64,;4.34,-6.41,;1.67,-3.33,;.34,-4.1,;-.99,-3.33,;-.99,-1.79,;.34,-1.02,;1.67,-1.79,;-2.33,-1.02,;-2.33,.52,;-3.66,1.29,;-5,.52,;-6.46,.99,;-7.36,-.25,;-6.46,-1.5,;-5,-1.02,;-3.66,-1.79,;-8.9,-.25,;-9.67,-1.59,;-9.67,1.08,;-8.9,2.41,;-9.67,3.75,;-8.9,5.08,;-7.36,5.08,;-6.59,6.41,;-6.59,3.75,;-5.05,3.75,;-7.36,2.41,)\|
BDBM209526	OC(=O)C[C@H]1CCC(CC1)c1ccc(cc1)-c1ccc2nc(cn2c1)C(=O)NCc1ccc2OCOc2c1 \|r,wD:4.3,(12.82,-6.32,;11.49,-5.55,;11.49,-4.01,;10.15,-6.32,;8.82,-5.55,;8.82,-4.01,;7.48,-3.24,;6.15,-4.01,;6.15,-5.55,;7.48,-6.32,;4.82,-3.24,;3.48,-4.01,;2.15,-3.24,;2.15,-1.7,;3.48,-.93,;4.82,-1.7,;.82,-.93,;.82,.61,;-.52,1.38,;-1.85,.61,;-3.32,1.09,;-4.22,-.16,;-3.32,-1.41,;-1.85,-.93,;-.52,-1.7,;-5.76,-.16,;-6.53,-1.49,;-6.53,1.17,;-8.07,1.17,;-8.84,2.51,;-8.07,3.84,;-8.84,5.18,;-10.38,5.18,;-11.41,6.32,;-12.82,5.69,;-12.66,4.16,;-11.15,3.84,;-10.38,2.51,)\|
BDBM209527	OC(=O)C[C@H]1CCC(CC1)c1ccc(cc1)-c1ccc2nc(cn2c1)C(=O)Nc1ccc(Cl)c(Cl)c1 \|r,wD:4.3,(9.67,-6.41,;8.34,-5.64,;8.34,-4.1,;7.01,-6.41,;5.67,-5.64,;5.67,-4.1,;4.34,-3.33,;3.01,-4.1,;3.01,-5.64,;4.34,-6.41,;1.67,-3.33,;.34,-4.1,;-.99,-3.33,;-.99,-1.79,;.34,-1.02,;1.67,-1.79,;-2.33,-1.02,;-2.33,.52,;-3.66,1.29,;-5,.52,;-6.46,.99,;-7.36,-.25,;-6.46,-1.5,;-5,-1.02,;-3.66,-1.79,;-8.9,-.25,;-9.67,-1.59,;-9.67,1.08,;-8.9,2.41,;-9.67,3.75,;-8.9,5.08,;-7.36,5.08,;-6.59,6.41,;-6.59,3.75,;-5.05,3.75,;-7.36,2.41,)\|
BDBM209528	OC(=O)C[C@H]1CCC(CC1)c1ccc(cc1)-c1ccc2nc(cn2c1)C(=O)Nc1cccc(Cl)c1 \|r,wD:4.3,(9.68,-5.75,;8.34,-4.98,;8.34,-3.44,;7.01,-5.75,;5.67,-4.98,;5.67,-3.44,;4.34,-2.67,;3.01,-3.44,;3.01,-4.98,;4.34,-5.75,;1.67,-2.67,;.34,-3.44,;-.99,-2.67,;-.99,-1.13,;.34,-.36,;1.67,-1.13,;-2.33,-.36,;-2.33,1.18,;-3.66,1.95,;-5,1.18,;-6.46,1.66,;-7.37,.41,;-6.46,-.83,;-5,-.36,;-3.66,-1.13,;-8.91,.41,;-9.68,-.92,;-9.68,1.75,;-8.91,3.08,;-9.68,4.41,;-8.91,5.75,;-7.37,5.75,;-6.6,4.41,;-5.06,4.41,;-7.37,3.08,)\|
BDBM209529	OC(=O)C[C@H]1CCC(CC1)c1ccc(cc1)-c1ccc2nc(cn2c1)C(=O)NCc1ccc(F)c(Cl)c1 \|r,wD:4.3,(11.99,-6.41,;10.65,-5.64,;10.65,-4.1,;9.32,-6.41,;7.98,-5.64,;7.98,-4.1,;6.65,-3.33,;5.32,-4.1,;5.32,-5.64,;6.65,-6.41,;3.98,-3.33,;2.65,-4.1,;1.32,-3.33,;1.32,-1.79,;2.65,-1.02,;3.98,-1.79,;-.02,-1.02,;-.02,.52,;-1.35,1.29,;-2.69,.52,;-4.15,.99,;-5.06,-.25,;-4.15,-1.5,;-2.69,-1.02,;-1.35,-1.79,;-6.6,-.25,;-7.37,-1.59,;-7.37,1.08,;-8.91,1.08,;-9.68,2.41,;-11.22,2.41,;-11.99,3.75,;-11.22,5.08,;-11.99,6.41,;-9.68,5.08,;-8.91,6.41,;-8.91,3.75,)\|
BDBM209530	COc1ccc(OC(F)(F)F)cc1CNC(=O)c1cn2cc(ccc2n1)-c1ccc(cc1)C1CC[C@H](CC(O)=O)CC1 \|r,wD:35.39,(-5.83,5.49,;-6.6,4.16,;-8.14,4.16,;-8.91,5.49,;-10.45,5.49,;-11.22,4.16,;-12.76,4.16,;-13.84,3.07,;-14.93,1.98,;-12.76,1.98,;-14.61,4.41,;-10.45,2.83,;-8.91,2.83,;-8.14,1.49,;-6.6,1.49,;-5.83,.16,;-6.6,-1.17,;-4.29,.16,;-3.38,-1.09,;-1.92,-.61,;-.58,-1.38,;.75,-.61,;.75,.93,;-.58,1.7,;-1.92,.93,;-3.38,1.41,;2.09,-1.38,;2.09,-2.92,;3.42,-3.69,;4.75,-2.92,;4.75,-1.38,;3.42,-.61,;6.09,-3.69,;7.42,-2.92,;8.75,-3.69,;8.75,-5.23,;10.09,-6,;11.42,-5.23,;12.76,-6,;11.42,-3.69,;7.42,-6,;6.09,-5.23,)\|
BDBM209531	CC(C)c1ccc(CNC(=O)c2cn3cc(ccc3n2)-c2ccc(cc2)C2CC[C@H](CC(O)=O)CC2)cc1 \|r,wD:29.32,(-10.45,7.08,;-11.22,5.75,;-12.76,5.75,;-10.45,4.41,;-8.91,4.41,;-8.14,3.08,;-8.91,1.75,;-8.14,.41,;-6.6,.41,;-5.83,-.92,;-6.6,-2.25,;-4.28,-.92,;-3.38,-2.17,;-1.92,-1.69,;-.58,-2.46,;.75,-1.69,;.75,-.15,;-.58,.62,;-1.92,-.15,;-3.38,.32,;2.09,-2.46,;2.09,-4,;3.42,-4.77,;4.75,-4,;4.75,-2.46,;3.42,-1.69,;6.09,-4.77,;7.42,-4,;8.75,-4.77,;8.75,-6.31,;10.09,-7.08,;11.42,-6.31,;12.76,-7.08,;11.42,-4.77,;7.42,-7.08,;6.09,-6.31,;-10.45,1.75,;-11.22,3.08,)\|
BDBM209532	CC(C)(NC(=O)c1cn2cc(ccc2n1)-c1ccc(cc1)C1CC[C@H](CC(O)=O)CC1)c1ccc(F)cc1 \|r,wD:24.27,(-9.68,-.25,;-8.91,1.08,;-10.24,.31,;-7.37,1.08,;-6.6,-.25,;-7.37,-1.59,;-5.06,-.25,;-4.15,-1.5,;-2.69,-1.02,;-1.35,-1.79,;-.02,-1.02,;-.02,.52,;-1.35,1.29,;-2.69,.52,;-4.15,.99,;1.32,-1.79,;1.32,-3.33,;2.65,-4.1,;3.98,-3.33,;3.98,-1.79,;2.65,-1.02,;5.32,-4.1,;6.65,-3.33,;7.98,-4.1,;7.98,-5.64,;9.32,-6.41,;10.65,-5.64,;11.99,-6.41,;10.65,-4.1,;6.65,-6.41,;5.32,-5.64,;-9.68,2.41,;-8.91,3.75,;-9.68,5.08,;-11.22,5.08,;-11.99,6.41,;-11.99,3.75,;-11.22,2.41,)\|
BDBM209533	OC(=O)C[C@H]1CCC(CC1)c1ccc(cc1)-c1ccc2nc(cn2c1)C(=O)NC1(CC1)c1cc(F)ccc1F \|r,wD:4.3,(11.21,-5.75,;9.88,-4.98,;9.88,-3.44,;8.55,-5.75,;7.21,-4.98,;7.21,-3.44,;5.88,-2.67,;4.55,-3.44,;4.55,-4.98,;5.88,-5.75,;3.21,-2.67,;1.88,-3.44,;.55,-2.67,;.55,-1.13,;1.88,-.36,;3.21,-1.13,;-.79,-.36,;-.79,1.18,;-2.12,1.95,;-3.46,1.18,;-4.92,1.66,;-5.82,.41,;-4.92,-.83,;-3.46,-.36,;-2.12,-1.13,;-7.36,.41,;-8.13,-.92,;-8.13,1.75,;-9.67,1.75,;-10.44,.41,;-11.21,1.75,;-8.9,3.08,;-7.36,3.08,;-6.59,4.41,;-5.05,4.41,;-7.36,5.75,;-8.9,5.75,;-9.67,4.41,;-11.21,4.41,)\|
BDBM209534	Cc1cccc(Cl)c1CNC(=O)c1cn2cc(ccc2n1)-c1ccc(cc1)C1CC[C@H](CC(O)=O)CC1 \|r,wD:30.34,(-10.83,2.41,;-10.06,3.75,;-10.83,5.08,;-10.06,6.41,;-8.52,6.41,;-7.75,5.08,;-6.21,5.08,;-8.52,3.75,;-7.75,2.41,;-8.52,1.08,;-7.75,-.25,;-8.52,-1.59,;-6.21,-.25,;-5.3,-1.5,;-3.84,-1.02,;-2.51,-1.79,;-1.17,-1.02,;-1.17,.52,;-2.51,1.29,;-3.84,.52,;-5.3,.99,;.16,-1.79,;.16,-3.33,;1.49,-4.1,;2.83,-3.33,;2.83,-1.79,;1.49,-1.02,;4.16,-4.1,;5.5,-3.33,;6.83,-4.1,;6.83,-5.64,;8.16,-6.41,;9.5,-5.64,;10.83,-6.41,;9.5,-4.1,;5.5,-6.41,;4.16,-5.64,)\|
BDBM209535	COc1ccc(CNC(=O)c2cn3cc(ccc3n2)-c2ccc(cc2)C2CC[C@H](CC(O)=O)CC2)cc1OC \|r,wD:28.31,(-12.37,6.27,;-10.83,6.27,;-10.06,4.94,;-10.83,3.61,;-10.06,2.27,;-8.52,2.27,;-7.75,.94,;-8.52,-.39,;-7.75,-1.73,;-8.52,-3.06,;-6.21,-1.73,;-5.3,-2.97,;-3.84,-2.5,;-2.51,-3.27,;-1.17,-2.5,;-1.17,-.96,;-2.51,-.19,;-3.84,-.96,;-5.3,-.48,;.16,-3.27,;.16,-4.81,;1.49,-5.58,;2.83,-4.81,;2.83,-3.27,;1.49,-2.5,;4.16,-5.58,;5.5,-4.81,;6.83,-5.58,;6.83,-7.12,;8.16,-7.89,;9.5,-7.12,;10.83,-7.89,;9.5,-5.58,;5.5,-7.89,;4.16,-7.12,;-7.75,3.61,;-8.49,4.99,;-7.72,6.32,;-8.49,7.66,)\|
BDBM209536	CC(NC(=O)c1cn2cc(ccc2n1)-c1ccc(cc1)C1CC[C@H](CC(O)=O)CC1)c1ccccc1 \|r,wD:23.26,(-6.2,2.41,;-7.75,2.41,;-8.52,1.08,;-7.75,-.25,;-8.52,-1.59,;-6.21,-.25,;-5.3,-1.5,;-3.84,-1.02,;-2.51,-1.79,;-1.17,-1.02,;-1.17,.52,;-2.51,1.29,;-3.84,.52,;-5.3,.99,;.16,-1.79,;.16,-3.33,;1.49,-4.1,;2.83,-3.33,;2.83,-1.79,;1.49,-1.02,;4.16,-4.1,;5.5,-3.33,;6.83,-4.1,;6.83,-5.64,;8.16,-6.41,;9.5,-5.64,;10.83,-6.41,;9.5,-4.1,;5.5,-6.41,;4.16,-5.64,;-8.52,3.75,;-7.75,5.08,;-8.52,6.41,;-10.06,6.41,;-10.83,5.08,;-10.06,3.75,)\|
BDBM209537	OC(=O)C[C@H]1CCC(CC1)c1ccc(cc1)-c1ccc2nc(cn2c1)C(=O)NCc1ccc(Oc2ccc(F)cc2)cc1 \|r,wD:4.3,(15.07,-7.08,;13.73,-6.31,;13.73,-4.77,;12.4,-7.08,;11.06,-6.31,;11.06,-4.77,;9.73,-4,;8.4,-4.77,;8.4,-6.31,;9.73,-7.08,;7.06,-4,;5.73,-4.77,;4.4,-4,;4.4,-2.46,;5.73,-1.69,;7.06,-2.46,;3.06,-1.69,;3.06,-.15,;1.73,.62,;.39,-.15,;-1.07,.32,;-1.98,-.92,;-1.07,-2.17,;.39,-1.69,;1.73,-2.46,;-3.52,-.92,;-4.29,-2.25,;-4.29,.41,;-5.83,.41,;-6.6,1.75,;-8.14,1.75,;-8.91,3.08,;-8.14,4.41,;-8.91,5.75,;-10.45,5.75,;-11.22,4.41,;-12.76,4.41,;-13.53,5.75,;-15.07,5.75,;-12.76,7.08,;-11.22,7.08,;-6.6,4.41,;-5.83,3.08,)\|
BDBM209538	OC(=O)C[C@H]1CCC(CC1)c1ccc(cc1)-c1ccc2nc(cn2c1)C(=O)NCc1ccc2OCCCOc2c1 \|r,wD:4.3,(12.21,-7.42,;10.74,-6.62,;10.74,-5.08,;9.43,-7.3,;8.1,-6.53,;8.1,-4.99,;6.76,-4.22,;5.43,-4.99,;5.43,-6.53,;6.76,-7.3,;4.1,-4.22,;2.76,-4.99,;1.43,-4.22,;1.43,-2.68,;2.76,-1.91,;4.1,-2.68,;.1,-1.91,;.1,-.37,;-1.24,.4,;-2.57,-.37,;-4.04,.11,;-4.94,-1.14,;-4.04,-2.39,;-2.57,-1.91,;-1.24,-2.68,;-6.48,-1.14,;-7.25,-2.47,;-7.25,.19,;-6.48,1.53,;-7.25,2.86,;-6.48,4.19,;-7.25,5.53,;-8.79,5.53,;-9.35,6.96,;-10.83,7.42,;-12.1,6.55,;-12.21,5.01,;-11.09,3.97,;-9.56,4.19,;-8.79,2.86,)\|
BDBM209539	OC(=O)C[C@H]1CCC(CC1)c1ccc(cc1)-c1ccc2nc(cn2c1)C(=O)NCc1c(F)cccc1Cl \|r,wD:4.3,(12.04,-5.81,;10.57,-5.01,;10.57,-3.47,;9.26,-5.69,;7.93,-4.92,;7.93,-3.38,;6.59,-2.61,;5.26,-3.38,;5.26,-4.92,;6.59,-5.69,;3.93,-2.61,;2.59,-3.38,;1.26,-2.61,;1.26,-1.07,;2.59,-.3,;3.93,-1.07,;-.08,-.3,;-.08,1.24,;-1.41,2.01,;-2.74,1.24,;-4.21,1.72,;-5.11,.47,;-4.21,-.78,;-2.74,-.3,;-1.41,-1.07,;-6.65,.47,;-7.42,-.86,;-7.42,1.8,;-8.96,1.8,;-9.73,3.14,;-8.96,4.47,;-7.42,4.47,;-9.73,5.81,;-11.27,5.81,;-12.04,4.47,;-11.27,3.14,;-12.04,1.8,)\|
BDBM209540	OC(=O)C[C@H]1CCC(CC1)c1ccc(cc1)-c1ccc2nc(cn2c1)C(=O)NCc1c(Cl)cccc1Cl \|r,wD:4.3,(12.04,-5.81,;10.56,-5.01,;10.56,-3.47,;9.26,-5.69,;7.93,-4.92,;7.93,-3.38,;6.59,-2.61,;5.26,-3.38,;5.26,-4.92,;6.59,-5.69,;3.93,-2.61,;2.59,-3.38,;1.26,-2.61,;1.26,-1.07,;2.59,-.3,;3.93,-1.07,;-.08,-.3,;-.08,1.24,;-1.41,2.01,;-2.74,1.24,;-4.21,1.72,;-5.11,.47,;-4.21,-.78,;-2.74,-.3,;-1.41,-1.07,;-6.65,.47,;-7.42,-.86,;-7.42,1.8,;-8.96,1.8,;-9.73,3.14,;-11.27,3.14,;-12.04,1.8,;-12.04,4.47,;-11.27,5.81,;-9.73,5.81,;-8.96,4.47,;-7.42,4.47,)\|
BDBM50143817	CC(C)C[C@H](OC(=O)C(C)(C)C)C(=O)NC1(CCCC1)C(=O)N[C@@H](CCc1ccccc1)C(=O)OC(C)(C)C \|r\|
BDBM50143818	CC(C)C[C@H](OC(=O)C(C)(C)C)C(=O)NC1(CCCC1)C(=O)N[C@@H](CCc1ccccc1)c1nc(no1)C1CC1 \|r\|
BDBM50143819	CCOC[C@H](CCc1ccccc1)NC(=O)C1(CCCC1)NC(=O)CC1C2CC3CC(C2)CC1C3 \|r,wU:4.4,TLB:34:33:31:27.28.29,THB:29:28:25:31.30.32,29:30:25:27.28.34,24:25:31:27.28.29,34:28:31:25.33.32,(4.59,-7.32,;4.65,-6.09,;6.03,-5.39,;6.11,-3.85,;7.48,-3.15,;8.77,-3.99,;8.69,-5.53,;9.98,-6.37,;9.9,-7.91,;11.19,-8.75,;12.56,-8.05,;12.64,-6.51,;11.35,-5.67,;7.56,-1.61,;6.27,-.77,;5.17,-1.33,;6.35,.77,;7.67,.04,;8.76,1.13,;8.06,2.5,;6.54,2.26,;5.06,1.61,;3.69,.91,;3.62,-.32,;2.4,1.75,;1.01,1.05,;-.28,1.69,;-1.04,.44,;-1.04,-1.32,;-2.25,-2.11,;-1.85,-.7,;-2.02,.73,;-.4,-.88,;1.11,-.36,;.37,-1.59,)\|
BDBM50143820	CCOC[C@H](CCc1ccccc1)NS(=O)(=O)c1cccc(NC(=O)[C@H](CC(C)C)OC(=O)C(C)(C)C)c1 \|r\|
BDBM50143822	CC(C)(C)c1nc(NC(=O)C(C)(C)NC(=O)C2(C)CC2)nn1-c1ccc(F)cc1
BDBM50143829	CC(C)(C)c1nc(NC(=O)C(C)(C)NC(=O)C2(CC2)C(F)(F)F)nn1-c1ccc(F)cc1
BDBM50143882	CC(C)(NC(=O)C1(CC1)C(F)(F)F)C(=O)Nc1nc(-c2ccc(F)cc2)n(n1)-c1ccc(F)cc1
BDBM50143880	CC(C)(C)c1nc(NC(=O)C(C)(C)NC(=O)c2ccc(F)cc2)nn1-c1ccc(F)cc1
BDBM50143881	CC(C)(NC(=O)C1(CC1)C(F)(F)F)C(=O)Nc1nc(n(n1)-c1ccc(F)cc1)C(C)(C)c1ccc(F)cc1
BDBM50143883	Cc1cc(F)ccc1-n1nc(NC(=O)C(C)(C)NC(=O)C2(CC2)C(F)(F)F)nc1-c1ccc(F)cc1
BDBM201239	COc1ccc(NC(=O)C2=C(C[C@](NC2=O)(c2ccc(OCCCC(F)(F)F)cc2)C(F)(F)F)c2ccc(C)cc2)cc1 \|r,t:9\|
BDBM50117665	COc1cccc(CC(=O)N2Cc3ccc(cc3C2)S(=O)(=O)Nc2cnn(n2)C2CCC2)c1
BDBM220916	CC(C)(COc1ccc(cc1)-c1ccc(cn1)-c1ncc([nH]1)C1CCCCCC1)C(O)=O
BDBM220917	CCCc1cnc([nH]1)-c1ccc(nc1)-c1ccc(OCC(C)(C)C(O)=O)cc1
BDBM220918	CC(C)(COc1ccc(cc1)-c1ccc(cn1)-c1ncc([nH]1)C1CC(F)(F)C1)C(O)=O
BDBM220919	CC(C)(COc1ccc(cc1)-c1ccc(cn1)-c1ncc([nH]1)C1CCC(F)(F)CC1)C(O)=O
BDBM220920	Cc1cc(ncc1-c1ncc([nH]1)C1(CC1)C(F)(F)F)-c1ccc(OCC(C)(C)C(O)=O)cc1
BDBM220921	Cc1cc(OCC(C)(C)C(O)=O)ncc1-c1ccc(nc1)-c1ncc([nH]1)C1(CC1)C(F)(F)F
BDBM220922	Cc1cc(ccc1-c1ncc([nH]1)C1(CC1)C(F)(F)F)-c1cnc(OCC(C)(C)C(O)=O)cc1C
BDBM220923	Cc1cc(ccc1-c1ncc([nH]1)C1(CC1)C(F)(F)F)-c1ccc(OCC(C)(C)C(O)=O)nc1
BDBM220924	Cc1cc(OCC(C)(C)C(O)=O)ncc1-c1ccc(cc1)-c1ncc([nH]1)C1(CC1)C(F)(F)F
BDBM220925	Cc1cc(OCC(C)(C)C(O)=O)ncc1-c1ccc(cc1)-c1ncc([nH]1)C(C)(C)C(F)(F)F
BDBM220926	Cc1cc(OCC(C)(C)C(O)=O)ncc1-c1ccc(cc1)-c1ncc([nH]1)C1(CCC1)C(F)(F)F
BDBM220927	Cc1cc(ccc1-c1ncc([nH]1)C1(CCC1)C(F)(F)F)-c1cnc(OCC(C)(C)C(O)=O)cc1C
BDBM220928	Cc1cc(ccc1-c1ncc([nH]1)C1(CCC1)C(F)(F)F)-c1ccc(OCC(C)(C)C(O)=O)nc1
BDBM220929	Cc1cc(ccc1-c1ncc([nH]1)C(C)(C)C(F)(F)F)-c1cnc(OCC(C)(C)C(O)=O)cc1C
BDBM220930	CC(C)(COc1ccc(cn1)-c1ccc(-c2ncc([nH]2)C2(CC2)C(F)(F)F)c(F)c1)C(O)=O
BDBM220931	Cc1cc(OCC(C)(C)C(O)=O)ncc1-c1ccc(nc1)-c1ncc([nH]1)C1(CCC1)C(F)(F)F
BDBM220932	Cc1cc(OCC(C)(C)C(O)=O)ncc1-c1ccc(nc1)-c1ncc([nH]1)C(C)(C)C(F)(F)F
BDBM220933	CC(C)(COc1cnc(cn1)-c1ccc(cc1)-c1ncc([nH]1)C1(CCC1)C(F)(F)F)C(O)=O
BDBM220934	CC(C)(COc1cnc(cn1)-c1ccc(cc1)-c1ncc([nH]1)C1(CC1)C(F)(F)F)C(O)=O
BDBM220935	CC(C)(COc1cnc(cn1)-c1ccc(cc1)-c1ncc([nH]1)C(C)(C)C(F)(F)F)C(O)=O
BDBM220936	CC(C)(COc1cnc(cn1)-c1ccc(-c2ncc([nH]2)C2(CC2)C(F)(F)F)c(F)c1)C(O)=O
BDBM220937	Cc1cc(OCC(C)(C)C(O)=O)ncc1-c1ccc(-c2ncc([nH]2)C2(CCC2)C(F)(F)F)c(F)c1
BDBM220938	CC(C)(COc1ccc(cn1)-c1ccc(-c2ncc([nH]2)C(C)(C)C(F)(F)F)c(F)c1)C(O)=O
BDBM220939	Cc1cc(OCC(C)(C)C(O)=O)ncc1-c1ccc(-c2ncc([nH]2)C2(CC2)C(F)(F)F)c(F)c1
BDBM220940	COC(=O)C(C)(C)COc1ccc(cc1)-c1ccc(cn1)-c1ncc([nH]1)C1CCC1
BDBM220941	CC(C)(COc1ccc(cc1)-c1ccc(cn1)-c1ncc([nH]1)C1CCCCC1)C(O)=O
BDBM220942	CC(C)(C)c1cnc([nH]1)-c1ccc(nc1)-c1ccc(OCC(C)(C)C(O)=O)cc1
BDBM220943	CCc1cnc([nH]1)-c1ccc(nc1)-c1ccc(OCC(C)(C)C(O)=O)cc1
BDBM220944	CC(C)Cc1cnc([nH]1)-c1ccc(nc1)-c1ccc(OCC(C)(C)C(O)=O)nc1
BDBM220945	OC(=O)C1(COc2ccc(cc2)-c2ccc(cn2)-c2nc(c[nH]2)C(F)(F)F)CC1
BDBM220990	Cc1cc(ccc1-c1ncc([nH]1)C(F)(F)F)-c1cnc(OCC(C)(C)C(O)=O)nc1
BDBM220946	Cc1cc(OCC(C)(C)C(O)=O)ncc1-c1ccc(nc1)-c1nc(c[nH]1)C(F)(F)F
BDBM220947	Cc1cc(OCC(C)(C)C(O)=O)ncc1-c1ccc(-c2nc(c[nH]2)C(F)(F)F)c(F)c1
BDBM220948	Cc1cc(OCC(C)(C)C(O)=O)ncc1-c1ccc(-c2nc(c[nH]2)C(F)(F)F)c(Cl)c1
BDBM220949	CC(C)(COc1ccc(c(F)c1)-c1ccc(cn1)-c1ncc([nH]1)C(F)(F)F)C(O)=O
BDBM220950	CC(C)(COc1ccc(cc1)-c1ccc(cn1)-c1ncc([nH]1)C(F)(F)F)CC(O)=O
BDBM220951	CC(C)(COc1ccc(cn1)-c1ccc(nc1)-c1ncc([nH]1)C(F)(F)F)C(O)=O
BDBM220952	CC(C)(COc1ncc(cn1)-c1ccc(cc1)-c1ncc([nH]1)C(F)(F)F)C(O)=O
BDBM220953	CC(C)(COc1ccc(cc1)-c1ccc(nc1)-c1ncc([nH]1)C(F)(F)F)C(O)=O
BDBM220954	CC(C)(COc1ccc(cc1)-c1ccc(cn1)-c1ncc([nH]1)C(F)(F)C(F)(F)F)C(O)=O
BDBM220955	Cc1cc(OCC2(CCC2)C(O)=O)ccc1-c1ccc(cn1)-c1ncc([nH]1)C(F)(F)F
BDBM220956	Cc1cc(OCC2(CC2)C(O)=O)ccc1-c1ccc(cn1)-c1ncc([nH]1)C(F)(F)F
BDBM220957	Cc1cc(OCC(C)(C)C(O)=O)ncc1-c1ccc(cn1)-c1ncc([nH]1)C(F)(F)F
BDBM220395	OC(=O)CC[C@H](NC(=O)N[C@@H](CCCCn1cc(CNc2ccc(cc2[N+]([O-])=O)[N+]([O-])=O)nn1)C(O)=O)C(O)=O
BDBM220396	OC(=O)CC[C@H](NC(=O)N[C@@H](CCCCn1cc(COCCNc2ccc(cc2[N+]([O-])=O)[N+]([O-])=O)nn1)C(O)=O)C(O)=O
BDBM220397	OC(=O)CC[C@H](NC(=O)N[C@@H](CCCCn1cc(COCCOCCNc2ccc(cc2[N+]([O-])=O)[N+]([O-])=O)nn1)C(O)=O)C(O)=O
BDBM220398	OC(=O)CC[C@H](NC(=O)N[C@@H](CCCCn1cc(COCCOCCOCCOCCNc2ccc(cc2[N+]([O-])=O)[N+]([O-])=O)nn1)C(O)=O)C(O)=O
BDBM220958	Cc1cc(OCC(C)(C)C(O)=O)ncc1-c1ccc(cc1)-c1ncc([nH]1)C(F)(F)F
BDBM220959	Cc1nc(OCC(C)(C)C(O)=O)ccc1-c1ccc(cc1)-c1ncc([nH]1)C(F)(F)F
BDBM220960	CC(C)(COc1ccc(c(F)c1F)-c1ccc(cn1)-c1ncc([nH]1)C(F)(F)F)C(O)=O
BDBM220961	CC(C)(COc1ccc(cn1)-c1ccc(-c2ncc([nH]2)C(F)(F)F)c(F)c1)C(O)=O
BDBM220962	Cc1cc(ccc1-c1ncc([nH]1)C(F)(F)F)-c1cnc(OCC(C)(C)C(O)=O)cc1C
BDBM220963	Cc1cc(ccc1-c1ncc([nH]1)C(F)(F)F)-c1ccc(OCC(C)(C)C(O)=O)nc1
BDBM220399	OC(=O)CC[C@H](NC(=O)N[C@@H](CCCCn1cc(COCCOCCOCCOCCOCCOCCNc2ccc(cc2[N+]([O-])=O)[N+]([O-])=O)nn1)C(O)=O)C(O)=O
BDBM220400	OC(=O)CC[C@H](NC(=O)N[C@@H](CCCCn1cc(COCCOCCOCCOCCOCCOCCOCCOCCNc2ccc(cc2[N+]([O-])=O)[N+]([O-])=O)nn1)C(O)=O)C(O)=O
BDBM220401	OC(=O)CC[C@H](NC(=O)N[C@@H](CCCCn1cc(COCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCNc2ccc(cc2[N+]([O-])=O)[N+]([O-])=O)nn1)C(O)=O)C(O)=O
BDBM220402	COCc1cn(CCCC[C@H](NC(=O)N[C@@H](CCC(O)=O)C(O)=O)C(O)=O)nn1
BDBM220403	COCCOCCOCc1cn(CCCC[C@H](NC(=O)N[C@@H](CCC(O)=O)C(O)=O)C(O)=O)nn1
BDBM220964	CC(C)(COc1ccc(cn1)-c1ccc(cc1F)-c1ncc([nH]1)C(F)(F)F)C(O)=O
BDBM220965	CC(C)(COc1ccc(cn1)-c1ccc(-c2ncc([nH]2)C(F)(F)F)c(F)c1F)C(O)=O
BDBM220967	CC(C)(COc1ncc(cc1F)-c1ccc(-c2ncc([nH]2)C(F)(F)F)c(Cl)c1)C(O)=O
BDBM220968	CC(C)(COc1ncc(cc1F)-c1ccc(nc1)-c1ncc([nH]1)C(F)(F)F)C(O)=O
BDBM220969	CC(C)(COc1ncc(cc1F)-c1ccc(-c2ncc([nH]2)C(F)(F)F)c(F)c1)C(O)=O
BDBM220404	COCCOCCOCCOCCOCc1cn(CCCC[C@H](NC(=O)N[C@@H](CCC(O)=O)C(O)=O)C(O)=O)nn1
BDBM220405	COCCOCCOCCOCCOCCOCCOCCOCCOCc1cn(CCCC[C@H](NC(=O)N[C@@H](CCC(O)=O)C(O)=O)C(O)=O)nn1
BDBM220406	COCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCc1cn(CCCC[C@H](NC(=O)N[C@@H](CCC(O)=O)C(O)=O)C(O)=O)nn1
BDBM220407	OC(=O)CC[C@H](NC(=O)N[C@@H](CCCCn1cc(COCCOCCNc2ccccc2[N+]([O-])=O)nn1)C(O)=O)C(O)=O
BDBM220408	OC(=O)CC[C@H](NC(=O)N[C@@H](CCCCn1cc(COCCOCCNc2ccc(cc2)[N+]([O-])=O)nn1)C(O)=O)C(O)=O
BDBM220970	CCc1cc(OCC(C)(C)C(O)=O)ccc1-c1ccc(cn1)-c1nc(c[nH]1)C(F)(F)F
BDBM220971	COc1cc(OCC(C)(C)C(O)=O)ccc1-c1ccc(cn1)-c1nc(c[nH]1)C(F)(F)F
BDBM220972	CC(C)(COc1ccc(cc1)-c1ccc(nn1)-c1ncc([nH]1)C(F)(F)F)C(O)=O
BDBM220973	CC(C)(COc1ccc(cc1)-c1ccc(cn1)-c1ncc([nH]1)C1(CCC1)C(F)(F)F)C(O)=O
BDBM220974	CC(C)(C(O)=O)c1cnc(cn1)-c1ccc(cc1)-c1nc(c[nH]1)C(F)(F)F
BDBM220975	CC(C)(COc1ncc(cc1F)-c1ccc(cc1)-c1ncc([nH]1)C(F)(F)F)C(O)=O
BDBM220409	OC(=O)CC[C@H](NC(=O)N[C@@H](CCCCn1cc(COCCOCCNc2ccccc2)nn1)C(O)=O)C(O)=O
BDBM220410	COc1ccc(NCCOCCOCc2cn(CCCC[C@H](NC(=O)N[C@@H](CCC(O)=O)C(O)=O)C(O)=O)nn2)cc1
BDBM220411	OC(=O)CC[C@H](NC(=O)N[C@@H](CCCCn1cc(COCCOCCNC2CCCCC2)nn1)C(O)=O)C(O)=O
BDBM220976	CC(C)(COc1cnc(cn1)-c1ccc(-c2ncc([nH]2)C(F)(F)F)c(F)c1)C(O)=O
BDBM220977	CC(C)(COc1cnc(cn1)-c1ccc(nc1)-c1ncc([nH]1)C(F)(F)F)C(O)=O
BDBM220978	CC(C)(COc1ccc(cc1)-c1ccc(cc1)-c1nc(c[nH]1)C(F)(F)F)C(O)=O
BDBM220980	Cc1cc(OCC(C)(C)C(O)=O)ncc1-c1cnc(cn1)-c1nc(c[nH]1)C(F)(F)F
BDBM220981	Cc1cc(OCC(C)(C)C(O)=O)ncc1-c1ccc(-c2ncc(CC3CC3)[nH]2)c(F)c1
BDBM220887	CC(C)(COc1ccc(cc1)-c1ccc(cn1)-c1ncc([nH]1)C(C)(C)C(F)(F)F)C(O)=O
BDBM220888	CC(C)(COc1ccc(cn1)-c1ccc(cc1)-c1nc(c[nH]1)C(F)(F)F)C(O)=O
BDBM220889	CC(C)(COc1ccc(cc1F)-c1ccc(cn1)-c1nc(c[nH]1)C(F)(F)F)C(O)=O
BDBM220890	Cc1cc(ncc1-c1nc(c[nH]1)C(F)(F)F)-c1ccc(OCC(C)(C)C(O)=O)cc1
BDBM220891	CC(C)(COc1ccc(cc1)-c1ccc(cn1)-c1ncc([nH]1)C1(CC1)C(F)(F)F)C(O)=O
BDBM220982	Cc1cc(OCC2(CCC2)C(O)=O)ncc1-c1ccc(nc1)-c1nc(c[nH]1)C(F)(F)F
BDBM220983	Cc1cc(OCC2(CCC2)C(O)=O)ncc1-c1ccc(-c2nc(c[nH]2)C(F)(F)F)c(F)c1
BDBM220984	Cc1cc(OCC2(CCC2)C(O)=O)ncc1-c1cnc(-c2nc(c[nH]2)C(F)(F)F)c(Cl)c1
BDBM220985	Cc1cc(OCC2(CC2)C(O)=O)ncc1-c1ccc(-c2nc(c[nH]2)C(F)(F)F)c(Cl)c1
BDBM220986	Cc1cc(OCC2(CCC2)C(O)=O)ncc1-c1ccc(-c2nc(c[nH]2)C(F)(F)F)c(Cl)c1
BDBM220892	CC(C)(COc1ccc(cc1)-c1cnc(cn1)-c1nc(c[nH]1)C(F)(F)F)C(O)=O
BDBM220893	Cc1cc(ccc1OCC(C)(C)C(O)=O)-c1ccc(cn1)-c1nc(c[nH]1)C(F)(F)F
BDBM220894	Cc1cc(OCC(C)(C)C(O)=O)ccc1-c1ccc(cn1)-c1ncc([nH]1)C(F)(F)F
BDBM220895	Cc1nc(OCC(C)(C)C(O)=O)ccc1-c1ccc(cn1)-c1ncc([nH]1)C(F)(F)F
BDBM220896	OC(=O)CCCOc1ccc(cc1)-c1ccc(cn1)-c1ncc([nH]1)C(F)(F)F
BDBM220897	CC(C)(COc1ccc(cc1)-c1ccc(cn1)-c1ncc(CC(F)F)[nH]1)C(O)=O
BDBM220898	CC(C)(COc1ccc(cn1)-c1ccc(cn1)-c1nc(c[nH]1)C(F)(F)F)C(O)=O
BDBM220899	OC(=O)C1(COc2ccc(cc2)-c2ccc(cn2)-c2ncc([nH]2)C(F)(F)F)CCC1
BDBM220900	OC(=O)CCCCOc1ccc(cc1)-c1ccc(cn1)-c1ncc([nH]1)C(F)(F)F
BDBM220901	OC(=O)C1(COc2ccc(cn2)-c2ccc(nc2)-c2ncc([nH]2)C(F)(F)F)CCCC1
BDBM220902	OC(=O)C1(COc2ccc(cn2)-c2ccc(cn2)-c2ncc([nH]2)C(F)(F)F)CCCC1
BDBM220903	CC(C)(CCOc1ccc(cc1)-c1ccc(cn1)-c1ncc([nH]1)C(F)(F)F)C(O)=O
BDBM220904	CCC(CC)(COc1ccc(cc1)-c1ccc(cn1)-c1nc(c[nH]1)C(F)(F)F)C(O)=O
BDBM220905	OC(=O)C1(COc2ccc(cc2)-c2ccc(cn2)-c2ncc([nH]2)C(F)(F)F)CCCC1
BDBM220906	OC(=O)C1(COc2ccc(cc2)-c2ccc(cn2)-c2ncc([nH]2)C(F)(F)F)CCOCC1
BDBM220907	CCC(CC)(COc1ccc(cn1)-c1ccc(cn1)-c1ncc([nH]1)C(F)(F)F)C(O)=O
BDBM220908	CCC(CC)(COc1ccc(cn1)-c1ccc(nc1)-c1ncc([nH]1)C(F)(F)F)C(O)=O
BDBM220909	CC(C)(COc1ccc(cc1)-c1ccc(cn1)-c1ncc(CCC(F)(F)F)[nH]1)C(O)=O
BDBM220910	CC(C)CCc1cnc([nH]1)-c1ccc(nc1)-c1ccc(OCC(C)(C)C(O)=O)cc1
BDBM220911	CC(C)Cc1cnc([nH]1)-c1ccc(nc1)-c1ccc(OCC(C)(C)C(O)=O)cc1
BDBM220912	CC(C)(COc1ccc(cc1)-c1ccc(cn1)-c1ncc(CC2CC2)[nH]1)C(O)=O
BDBM220913	CC(C)c1cnc([nH]1)-c1ccc(nc1)-c1ccc(OCC(C)(C)C(O)=O)cc1
BDBM220914	CCC(CC)c1cnc([nH]1)-c1ccc(nc1)-c1ccc(OCC(C)(C)C(O)=O)cc1
BDBM220915	CC(C)(COc1ccc(cc1)-c1ccc(cn1)-c1ncc(CCC2CC2)[nH]1)C(O)=O
BDBM176377	CCc1nc(no1)-c1ccc(cc1)N1CCN(CC1)C(=O)Nc1c(F)cccc1Cl
BDBM176378	COc1ccc(NC(=O)N2CCN(CC2)c2ccc(cc2)-c2nc3cnn(Cc4ccc(C)cc4)c3[nH]2)cc1
BDBM176379	Cc1ccc(Cn2ncc3nc([nH]c23)-c2ccc(cc2)N2CCN(CC2)C(=O)Nc2ccccc2)cc1
BDBM176380	Cc1ccc(Cn2ncc3nc([nH]c23)-c2ccc(cc2)N2CCN(CC2)C(=O)NC2CC2)cc1
BDBM176381	CC(=O)Nc1ccc(NC(=O)N2CCN(CC2)c2ccc(cc2)-c2nc3cnn(Cc4ccc(C)cc4)c3[nH]2)cc1
BDBM176382	Cc1nc(no1)-c1ccc(cc1)N1CCN(CC1)C(=O)Nc1ccccc1Br
BDBM176292	CC(C)n1ncn(-c2ccc(cc2)N2CCN(CC2)C(=O)Nc2c(Cl)cccc2Cl)c1=O
BDBM176286	Cc1ccc(Cn2ncc3nc([nH]c23)-c2ccc(cc2)N2CCN(CC2)C(=O)Nc2c(Cl)cccc2Cl)cc1
BDBM176287	Clc1cccc(Cl)c1NC(=O)N1CCN(CC1)c1ccc(cc1)-c1ccn(CCc2ccccc2)n1
BDBM176288	Clc1cccc(Cl)c1NC(=O)N1CCN(CC1)c1ccc(cc1)-c1ccnc(NC2CCCCC2)n1
BDBM176289	CCCCn1ncnc1-c1ccc(cc1)N1CCN(CC1)C(=O)Nc1c(Cl)cccc1Cl
BDBM176290	CCC(C(=O)c1ccc(Br)cc1)n1ncn(-c2ccc(cc2)N2CCN(CC2)C(=O)Nc2c(Cl)cccc2Cl)c1=O
BDBM176291	CC(c1ccccc1)n1ncn(-c2ccc(cc2)N2CCN(CC2)C(=O)Nc2c(Cl)cccc2Cl)c1=O
BDBM176383	Cc1ccc(Cn2ncc3nc([nH]c23)-c2ccc(cc2)N2CCN(CC2)C(=O)Nc2ccc3OCOc3c2)cc1
BDBM176384	CC(C)n1ncc2nc([nH]c12)-c1ccc(cc1)N1CCN(CC1)C(=O)Nc1cccc(F)c1
BDBM176386	Cc1ccc(Cn2ncc3nc([nH]c23)-c2ccc(cc2)N2CCN(CC2)C(=O)NCc2ccccc2)cc1
BDBM176387	Cc1ccc(Cn2ncc3nc([nH]c23)-c2ccc(cc2)N2CCN(CC2)C(=O)Nc2cccc(c2)N2CCOCC2)cc1
BDBM176314	COc1ccc(Cn2cnc(n2)-c2ccc(cc2)N2CCN(CC2)C(=O)Nc2c(Cl)cccc2Cl)cc1
BDBM181674	Clc1cccc(Cl)c1NC(=O)N1CCN(CC1)c1ccc(cc1)-c1ccn(CCCc2ccccc2)n1
BDBM182966	CC(C)n1ncc2nc([nH]c12)-c1ccc(cc1)N1CCN(CC1)C(=O)NCc1ccccc1
BDBM176293	CC(C)n1ncc2nc([nH]c12)-c1ccc(cc1)N1CCN(CC1)C(=O)Cc1c(Cl)cccc1Cl
BDBM176294	CC(C)n1ncc2nc([nH]c12)-c1ccc(cc1)N1CCN(CC1)C(=O)Nc1c(Cl)cccc1Cl
BDBM176295	Clc1cccc(Cl)c1NC(=O)N1CCN(CC1)c1ccc(cc1)-c1ccn(Cc2ccccc2)n1
BDBM176296	Clc1cccc(Cl)c1Cc1nccc(n1)-c1ccc(cc1)N1CCN(CC1)C(=O)Nc1c(Cl)cccc1Cl
BDBM176297	CCCCCc1nccc(n1)-c1ccc(cc1)N1CCN(CC1)C(=O)Nc1c(Cl)cccc1Cl
BDBM176388	CC(C)n1ncc2nc([nH]c12)-c1ccc(cc1)N1CCN(CC1)C(=O)Cc1ccccc1
BDBM176389	Cc1ccc(Cn2ncc3nc([nH]c23)-c2ccc(cc2)N2CCN(CC2)C(=O)Nc2ccc(C)cc2)cc1
BDBM176390	CC(C)n1ncc2nc([nH]c12)-c1ccc(cc1)N1CCN(CC1)C(=O)Nc1cccc(c1)N(C)C
BDBM176391	Fc1cccc(Cl)c1NC(=O)N1CCN(CC1)c1ccc(cc1)-c1noc(n1)C1CC1
BDBM176392	Cc1ccc(Cn2ncc3nc([nH]c23)-c2ccc(cc2)N2CCN(CC2)C(=O)Cc2ccccc2)cc1
BDBM176393	COc1ccc(NC(=O)N2CCN(CC2)c2ccc(cc2)-c2noc(n2)C2CCCCC2)c(OC)c1
BDBM176298	Clc1cccc(Cl)c1NC(=O)N1CCN(CC1)c1ccc(cc1)-c1ccnn1CCc1ccccc1
BDBM176299	Clc1cccc(Cl)c1CC(=O)N1CCN(CC1)c1ccc(cc1)-c1ccnc(n1)-c1ccccc1
BDBM176300	CCCCn1nccc1-c1ccc(cc1)N1CCN(CC1)C(=O)Nc1c(Cl)cccc1Cl
BDBM176301	CC(C)(C)c1nccc(n1)-c1ccc(cc1)N1CCN(CC1)C(=O)Nc1c(Cl)cccc1Cl
BDBM176302	CCOC(=O)N1CCC(CC1)Nc1nccc(n1)-c1ccc(cc1)N1CCN(CC1)C(=O)Nc1c(Cl)cccc1Cl
BDBM176303	COc1ccc(cc1)-n1nccc1-c1ccc(cc1)N1CCN(CC1)C(=O)Nc1c(Cl)cccc1Cl
BDBM176304	CC(C)CCNc1nccc(n1)-c1ccc(cc1)N1CCN(CC1)C(=O)Cc1c(Cl)cccc1Cl
BDBM176394	Cc1ccc(Cn2ncc3nc([nH]c23)-c2ccc(cc2)N2CCN(CC2)C(=O)CCc2ccccc2)cc1
BDBM176395	Cc1nc(no1)-c1ccc(cc1)N1CCN(CC1)C(=O)Cc1ccccc1Br
BDBM176396	CC(C)n1ncc2nc([nH]c12)-c1ccc(cc1)N1CCN(CC1)C(=O)Nc1ccc(Cl)cc1
BDBM176397	Brc1ccccc1CC(=O)N1CCN(CC1)c1ccc(cc1)-c1noc(n1)C1CCC1
BDBM176398	CC(C)n1ncc2nc([nH]c12)-c1ccc(cc1)N1CCN(CC1)C(=O)Nc1ccncc1
BDBM176399	CC(C)n1ncc2nc([nH]c12)-c1ccc(cc1)N1CCN(CC1)C(=O)Nc1ccc(cc1)C(O)=O
BDBM176305	Clc1cccc(Cl)c1NC(=O)N1CCN(CC1)c1ccc(cc1)-c1ccnc(NCc2ccccc2)n1
BDBM176306	Clc1cccc(Cl)c1NC(=O)N1CCN(CC1)c1ccc(cc1)-c1ccnc(n1)N1CCCCC1
BDBM176307	Clc1cccc(Cl)c1NC(=O)N1CCN(CC1)c1ccc(cc1)-c1ncnn1Cc1ccccc1
BDBM176308	Clc1cccc(Cl)c1NC(=O)N1CCN(CC1)c1ccc(cc1)-c1[nH]cnn1CCc1ccccc1
BDBM176309	CCC(C(O)c1ccc(Cl)cc1)n1ncn(-c2ccc(cc2)N2CCN(CC2)C(=O)Nc2c(Cl)cccc2Cl)c1=O
BDBM176310	CCC(C)n1ncn(-c2ccc(cc2)N2CCN(CC2)C(=O)Nc2c(Cl)cccc2Cl)c1=O
BDBM176400	Cc1ccc(Cn2ncc3nc([nH]c23)-c2ccc(cc2)N2CCN(CC2)C(=O)Nc2ccc(Cl)cc2)cc1
BDBM176401	Brc1ccccc1CC(=O)N1CCN(CC1)c1ccc(cc1)-c1noc(n1)C1CC1
BDBM176312	Cc1ccc(Cn2ncc3nc([nH]c23)-c2ccc(cc2)N2CCN(CC2)C(=O)Cc2c(Cl)cccc2Cl)cc1
BDBM176313	Clc1cccc(Cl)c1NC(=O)N1CCN(CC1)c1ccc(cc1)-c1ncn(CCc2ccccc2)n1
BDBM176315	Clc1cccc(Cl)c1NC(=O)N1CCN(CC1)c1ccc(cc1)-c1ncn(CCCc2ccccc2)n1
BDBM176316	Clc1cccc(Cl)c1NC(=O)N1CCN(CC1)c1ccc(cc1)-c1nnc(CCc2ccccc2)o1
BDBM176317	CCCCn1cnc(n1)-c1ccc(cc1)N1CCN(CC1)C(=O)Nc1c(Cl)cccc1Cl
BDBM176318	Clc1cccc(Cl)c1NC(=O)N1CCN(CC1)c1ccc(cc1)-c1nc(CCCc2ccccc2)no1
BDBM176319	Clc1cccc(Cl)c1NC(=O)N1CCN(CC1)c1ccc(cc1)-c1nc(Cc2ccccc2)no1
BDBM176320	Clc1cccc(Cl)c1NC(=O)N1CCN(CC1)c1ccc(cc1)-c1nnc(Cc2ccccc2)o1
BDBM176321	CCCCc1nnc(o1)-c1ccc(cc1)N1CCN(CC1)C(=O)Nc1c(Cl)cccc1Cl
BDBM176322	Clc1cccc(Cl)c1NC(=O)N1CCN(CC1)c1ccc(cc1)-c1nc(no1)-c1ccccc1
BDBM176323	CC(C)(C)c1nnc(o1)-c1ccc(cc1)N1CCN(CC1)C(=O)Nc1c(Cl)cccc1Cl
BDBM176324	CC(C)(C)c1noc(n1)-c1ccc(cc1)N1CCN(CC1)C(=O)Nc1c(Cl)cccc1Cl
BDBM176325	CC(C)(C)n1cnc(n1)-c1ccc(cc1)N1CCN(CC1)C(=O)Nc1c(Cl)cccc1Cl
BDBM176327	Clc1cccc(Cl)c1NC(=O)N1CCN(CC1)c1ccc(cc1)-c1ncnn1
BDBM176328	Clc1cccc(Cl)c1NC(=O)N1CCN(CC1)c1ccc(cc1)-c1cn2ccsc2n1
BDBM176329	Clc1cccc(Cl)c1NC(=O)N1CCC(CC1)c1ccc(cc1)-n1cnn(CCCc2ccccc2)c1=O
BDBM176330	COc1ccc(Cn2ncnc2-c2ccc(cc2)N2CCN(CC2)C(=O)Nc2c(Cl)cccc2Cl)cc1
BDBM176331	COc1ccc(Cn2ncn(-c3ccc(cc3)C3CCN(CC3)C(=O)Nc3c(Cl)cccc3Cl)c2=O)cc1
BDBM176332	CC(C)n1ncnc1-c1ccc(cc1)N1CCN(CC1)C(=O)Nc1c(Cl)cccc1Cl
BDBM176333	Clc1cccc(Cl)c1NC(=O)N1CCC(CC1)c1ccc(cc1)-n1cnn(CCc2ccccc2)c1=O
BDBM176334	Cc1nnc(o1)-c1ccc(cc1)N1CCN(CC1)C(=O)Nc1c(Cl)cccc1Cl
BDBM176335	Clc1cccc(Cl)c1NC(=O)N1CCN(CC1)c1ccc(cc1)-n1cnn(Cc2ccccc2)c1=O
BDBM176336	CCN(CC)CCCc1noc(n1)-c1ccc(cc1)N1CCN(CC1)C(=O)Nc1c(Cl)cccc1Cl
BDBM176337	Clc1cc(cc(Cl)c1NC(=O)N1CCN(CC1)c1ccc(cc1)-c1nc2n(ncc2[nH]1)C1CCCC1)N1CCCC1
BDBM176338	Clc1cc(CN2CCCC2)cc(Cl)c1NC(=O)N1CCN(CC1)c1ccc(cc1)-c1nc2cnn(-c3ccccc3)c2[nH]1
BDBM176339	CC(c1ccccc1)n1ncc2[nH]c(nc12)-c1ccc(cc1)N1CCN(CC1)C(=O)Nc1c(Cl)cc(cc1Cl)N1CCCC1
BDBM176340	Clc1cc(CN2CCCC2)cc(Cl)c1NC(=O)N1CCN(CC1)c1ccc(cc1)-c1nc2cnn(Cc3ccccc3)c2[nH]1
BDBM176341	OCc1cc(Cl)c(NC(=O)N2CCN(CC2)c2ccc(cc2)-c2ccn(CCc3ccccc3)n2)c(Cl)c1
BDBM176342	CC(C)n1ncc2nc([nH]c12)-c1ccc(cc1)N1CCN(CC1)C(=O)Nc1c(Cl)cc(CN2CCCC2)cc1Cl
BDBM176343	OCc1cc(Cl)c(NC(=O)N2CCN(CC2)c2ccc(cc2)-c2ccn(CCCc3ccccc3)n2)c(Cl)c1
BDBM176344	Clc1cc(CN2CCCC2)cc(Cl)c1NC(=O)N1CCN(CC1)c1ccc(cc1)-c1ncn(CCc2ccccc2)n1
BDBM176345	Oc1cc(Cl)c(NC(=O)N2CCN(CC2)c2ccc(cc2)-c2ccn(CCc3ccccc3)n2)c(Cl)c1
BDBM176346	Oc1cc(Cl)c(NC(=O)N2CCN(CC2)c2ccc(cc2)-c2ccn(CCCc3ccccc3)n2)c(Cl)c1
BDBM176347	COC(=O)c1cc(Cl)c(NC(=O)N2CCN(CC2)c2ccc(cc2)-c2ccn(CCc3ccccc3)n2)c(Cl)c1
BDBM176348	Clc1cc(CN2CCCC2)cc(Cl)c1NC(=O)N1CCN(CC1)c1ccc(cc1)-c1cn2ccsc2n1
BDBM176349	COC(=O)c1cc(Cl)c(NC(=O)N2CCN(CC2)c2ccc(cc2)-c2ccn(CCCc3ccccc3)n2)c(Cl)c1
BDBM176350	CC(C)n1ncc2nc([nH]c12)-c1ccc(cc1)N1CCN(CC1)C(=O)Nc1ccccc1C(F)(F)F
BDBM176351	CC(C)n1ncc2nc([nH]c12)-c1ccc(cc1)N1CCN(CC1)C(=O)Nc1ccccc1Cl
BDBM176352	Cc1ccc(Cn2ncc3nc([nH]c23)-c2ccc(cc2)N2CCN(CC2)C(=O)Nc2ccccc2C(F)(F)F)cc1
BDBM176353	CC(C)n1ncc2nc([nH]c12)-c1ccc(cc1)N1CCN(CC1)C(=O)Nc1ccc(Cl)cc1Cl
BDBM176354	Cc1ccc(Cn2ncc3nc([nH]c23)-c2ccc(cc2)N2CCN(CC2)C(=O)Nc2ccccc2Cl)cc1
BDBM176355	Cc1ccc(cc1)-c1nc([nH]o1)-c1ccc(cc1)N1CCN(CC1)C(=O)Nc1ccccc1Cl
BDBM176356	CC(C)n1ncc2nc([nH]c12)-c1ccc(cc1)N1CCN(CC1)C(=O)Nc1cccc2ccccc12
BDBM176357	FC(F)(F)c1ccccc1NC(=O)N1CCN(CC1)c1ccc(cc1)-c1noc(n1)C1CCCCC1
BDBM176358	Cc1ccc(NC(=O)N2CCN(CC2)c2ccc(cc2)-c2noc(n2)C2CC2)c(Cl)c1
BDBM176359	Cc1ccc(Cn2ncc3nc([nH]c23)-c2ccc(cc2)N2CCN(CC2)C(=O)Nc2ccc(Cl)cc2Cl)cc1
BDBM176360	Clc1ccccc1NC(=O)N1CCN(CC1)c1ccc(cc1)-c1noc(n1)C1CCCCC1
BDBM176361	Cc1ccc(Cn2ncc3nc([nH]c23)-c2ccc(cc2)N2CCN(CC2)C(=O)Nc2cccc3ccccc23)cc1
BDBM176362	CC(C)n1ncc2nc([nH]c12)-c1ccc(cc1)N1CCN(CC1)C(=O)Nc1ccc(cc1)N(C)C
BDBM176363	CN(C)c1ccc(NC(=O)N2CCN(CC2)c2ccc(cc2)-c2nc3cnn(Cc4ccc(C)cc4)c3[nH]2)cc1
BDBM176364	Brc1ccccc1NC(=O)N1CCN(CC1)c1ccc(cc1)-c1noc(n1)C1CCC1
BDBM176365	CC(C)n1ncc2nc([nH]c12)-c1ccc(cc1)N1CCN(CC1)C(=O)Nc1ccc(C)cc1
BDBM176366	COc1ccc(NC(=O)N2CCN(CC2)c2ccc(cc2)-c2nc3cnn(C(C)C)c3[nH]2)cc1
BDBM176367	COc1ccccc1NC(=O)N1CCN(CC1)c1ccc(cc1)-c1nc2cnn(Cc3ccc(C)cc3)c2[nH]1
BDBM176368	COc1ccccc1NC(=O)N1CCN(CC1)c1ccc(cc1)-c1nc2cnn(C(C)C)c2[nH]1
BDBM176369	CC(C)n1ncc2nc([nH]c12)-c1ccc(cc1)N1CCN(CC1)C(=O)Nc1cccc(C)c1
BDBM176370	CSc1ccc(NC(=O)N2CCN(CC2)c2ccc(cc2)-c2nc3cnn(C(C)C)c3[nH]2)cc1
BDBM176371	Cc1nc(no1)-c1ccc(cc1)N1CCN(CC1)C(=O)Nc1c(F)cccc1Cl
BDBM176372	CC(C)n1ncc2nc([nH]c12)-c1ccc(cc1)N1CCN(CC1)C(=O)Nc1ccc2ccccc2c1
BDBM176374	COc1cccc(NC(=O)N2CCN(CC2)c2ccc(cc2)-c2nc3cnn(C(C)C)c3[nH]2)c1
BDBM176375	CC(C)n1ncc2nc([nH]c12)-c1ccc(cc1)N1CCN(CC1)C(=O)Nc1cccc(c1)N1CCOCC1
BDBM176376	CC(C)n1ncc2nc([nH]c12)-c1ccc(cc1)N1CCN(CC1)C(=O)Nc1ccc2OCOc2c1
BDBM176373	CC(C)n1ncc2nc([nH]c12)-c1ccc(cc1)N1CCN(CC1)C(=O)Nc1ccccc1
BDBM321165	COc1ncc(cn1)-n1ccc2cc(ccc12)N1CCOc2ncnc(N)c2C1=O
BDBM321166	CCc1ccccc1-n1ccc2cc(ccc12)N1CCOc2ncnc(N)c2C1=O
BDBM321167	Cc1cnc(cn1)-n1ccc2cc(ccc12)N1CCOc2ncnc(N)c2C1=O
BDBM321168	Cc1nnc([nH]1)-n1ccc2cc(ccc12)N1CCOc2ncnc(N)c2C1=O
BDBM321169	COc1cccc(c1Br)-n1ccc2cc(ccc12)N1CCOc2ncnc(N)c2C1=O
BDBM321134	Nc1ncnc2OCCN(c3ccc4n(ccc4c3)C3COC3)C(=O)c12
BDBM321135	COc1cccc(c1)-n1ccc2cc(ccc12)N1CCOc2ncnc(N)c2C1=O
BDBM321136	Nc1ncnc2OCCN(c3cnc4n(ccc4c3)C3CCC3)C(=O)c12
BDBM321137	CC(C)(O)Cn1ccc2cc(ccc12)N1CCOc2ncnc(N)c2C1=O
BDBM321138	Nc1ncnc2OCCN(c3ccc4n(ccc4c3)-c3ccccc3OC(F)(F)F)C(=O)c12
BDBM321139	COc1cc(ccc1-n1ccc2cc(ccc12)N1CCOc2ncnc(N)c2C1=O)C(F)(F)F
BDBM321140	Nc1ncnc2OCCN(c3ccc4n(ccc4c3)-c3cccc(OC(F)F)c3)C(=O)c12
BDBM321141	CC(C)COc1cccc(c1)-n1ccc2cc(ccc12)N1CCOc2ncnc(N)c2C1=O
BDBM321142	CC(C)Oc1ccccc1-n1ccc2cc(ccc12)N1CCOc2ncnc(N)c2C1=O
BDBM321143	Nc1ncnc2OCCN(c3ccc4n(ccc4c3)-c3cc(Cl)cc(Cl)c3)C(=O)c12
BDBM321144	Nc1ncnc2OCCN(c3cnc4n(ccc4c3)-c3cc(Cl)cc(Cl)c3)C(=O)c12
BDBM321145	Nc1ncnc2OCCN(c3ccc4n(ccc4c3)-c3cccc(Cl)c3Cl)C(=O)c12
BDBM321146	Cc1ncc(cn1)-n1ccc2cc(ccc12)N1CCOc2ncnc(N)c2C1=O
BDBM321147	Cc1ccc(cn1)-n1ccc2cc(cnc12)N1CCOc2ncnc(N)c2C1=O
BDBM321148	Cn1cc(ccc1=O)-n1ccc2cc(ccc12)N1CCOc2ncnc(N)c2C1=O
BDBM321149	Nc1ncnc2OCCN(c3ccc4n(ccc4c3)-c3ccccc3O)C(=O)c12
BDBM321150	Nc1ncnc2OCCN(c3ccc4n(ccc4c3)-c3ccccc3OC3CCCC3)C(=O)c12
BDBM321151	Nc1ncnc2OCCN(c3cnc4n(ccc4c3)-c3ccccc3O)C(=O)c12
BDBM321152	Nc1ncnc2OCCN(c3cnc4n(ccc4c3)-c3ccccc3OC3CCCC3)C(=O)c12
BDBM321153	CCOc1ccccc1-n1ccc2cc(ccc12)N1CCOc2ncnc(N)c2C1=O
BDBM321154	Cc1nnc(o1)-n1ccc2cc(ccc12)N1CCOc2ncnc(N)c2C1=O
BDBM321155	CCCn1ccc2cc(cc(C3CC3)c12)N1CCOc2ncnc(N)c2C1=O
BDBM321156	COc1ccccc1-n1ccc2cc(cc(NC(=O)C3CC3)c12)N1CCOc2ncnc(N)c2C1=O
BDBM321157	CC(C)n1ccc2cc(cc(N3CCOCC3)c12)N1CCOc2ncnc(N)c2C1=O
BDBM321158	CC(C)n1ccc2cc(cc(NC(=O)C3CC3)c12)N1CCOc2ncnc(N)c2C1=O
BDBM321159	Cc1ccc(cn1)C1C=Cc2cc(NC(=O)OC(C)(C)C)cc(C3CC3)c12 \|c:9\|
BDBM321160	CCc1ncc(cn1)-n1ccc2cc(ccc12)N1CCOc2ncnc(N)c2C1=O
BDBM321161	COc1c(Cl)cccc1-n1ccc2cc(ccc12)N1CCOc2ncnc(N)c2C1=O
BDBM321162	COc1cc(C)ccc1-n1ccc2cc(ccc12)N1CCOc2ncnc(N)c2C1=O
BDBM321163	Nc1ncnc2OCCN(c3ccc4n(ccc4c3)C3CCOCC3)C(=O)c12
BDBM321164	COc1nc(C)ccc1-n1ccc2cc(ccc12)N1CCOc2ncnc(N)c2C1=O
BDBM336119	Nc1ncnc2OCCN(c3cnc4n(ccc4c3)C3COC3)C(=O)c12
BDBM336120	Nc1ncnc2OCCN(c3cnc4n(ccc4c3)-c3cccc(OC(F)(F)F)c3)C(=O)c12
BDBM336131	Cc1ncc(cn1)-n1ccc2cc(ccc12)N(CCO[Si](C)(C)C(C)(C)C)C(=O)c1c(Cl)ncnc1Cl
BDBM336139	Cc1nnc(o1)-n1ccc2cc(ccc12)N(CCO[Si](C)(C)C(C)(C)C)C(=O)c1c(Cl)cccc1Cl
BDBM336140	CCCn1ccc2cc(cc(C3CC3)c12)N(CCO[Si](C)(C)C(C)(C)C)C(=O)c1c(Cl)ncnc1Cl
BDBM336141	COc1ccccc1-n1ccc2cc(cc(NC(=O)C3CC3)c12)N(CCO[Si](C)(C)C(C)(C)C)C(=O)c1c(Cl)ncnc1Cl
BDBM336144	Cc1ccc(cn1)-n1ccc2cc(NC(=O)OC(C)(C)C)cc(C3CC3)c12
BDBM223525	CCc1ccc(cc1)-c1ccc(cc1)C(=O)NCCC(=O)Nc1ccc(cc1)C1CC[C@H](CC(O)=O)CC1 \|r,wD:31.34,$;;;;;;;;;;;;;;;;HN;;;;;HN;;;;;;;;;;;;;;;;$,(-13.75,6.57,;-13.75,5.03,;-12.41,4.26,;-11.03,5,;-9.7,4.23,;-9.7,2.69,;-11.03,1.92,;-12.36,2.69,;-8.18,1.92,;-6.85,2.69,;-5.52,1.92,;-5.52,.38,;-6.85,-.38,;-8.18,.38,;-4.18,-.38,;-4.18,-1.93,;-2.85,.38,;-1.51,-.38,;-.18,.38,;1.15,-.38,;1.15,-1.93,;2.49,.38,;3.82,-.38,;3.82,-1.93,;5.15,-2.69,;6.49,-1.93,;6.49,-.38,;5.15,.38,;7.82,-2.69,;9.16,-1.93,;10.49,-2.69,;10.49,-4.23,;12,-5,;13.52,-4.23,;15.03,-5,;13.52,-2.69,;9.16,-5,;7.82,-4.23,)\|
BDBM223526	OC(=O)C[C@H]1CCC(CC1)c1ccc(NC(=O)CCNC(=O)c2ccc(c(Cl)c2)-c2ccccc2)cc1 \|r,wD:4.3,$;;;;;;;;;;;;;;HN;;;;;HN;;;;;;;;;;;;;;;;;$,(13.34,-5,;12,-4.23,;12,-2.69,;10.67,-5,;9.34,-4.23,;9.34,-2.69,;8,-1.93,;6.67,-2.69,;6.67,-4.23,;8,-5,;5.33,-1.93,;4,-2.69,;2.67,-1.93,;2.67,-.38,;1.33,.38,;,-.38,;,-1.93,;-1.33,.38,;-2.67,-.38,;-4,.38,;-5.33,-.38,;-5.33,-1.93,;-6.67,.38,;-6.67,1.93,;-8,2.69,;-9.34,1.93,;-9.34,.38,;-10.67,-.38,;-8,-.38,;-10.67,2.69,;-10.67,4.23,;-12,5,;-13.34,4.23,;-13.34,2.69,;-12,1.93,;4,.38,;5.33,-.38,)\|
BDBM223527	OC(=O)C[C@H]1CCC(CC1)c1ccc(NC(=O)CCNC(=O)c2nc(oc2Cl)-c2ccccc2Cl)cc1 \|r,wD:4.3,$;;;;;;;;;;;;;;HN;;;;;HN;;;;;;;;;;;;;;;;;$,(13.5,-4.41,;12.16,-3.64,;12.16,-2.1,;10.83,-4.41,;9.5,-3.64,;9.5,-2.1,;8.16,-1.33,;6.83,-2.1,;6.83,-3.64,;8.16,-4.41,;5.5,-1.33,;4.16,-2.1,;2.83,-1.33,;2.83,.21,;1.49,.98,;.16,.21,;.16,-1.33,;-1.17,.98,;-2.51,.21,;-3.84,.98,;-5.17,.21,;-5.17,-1.33,;-6.51,.98,;-7.97,.5,;-8.88,1.75,;-7.97,2.99,;-6.51,2.52,;-5.17,3.29,;-10.42,1.75,;-11.19,.41,;-12.73,.41,;-13.5,1.75,;-12.73,3.08,;-11.19,3.08,;-10.42,4.41,;4.16,.98,;5.5,.21,)\|
BDBM223528	OC(=O)C[C@H]1CCC(CC1)c1ccc(NC(=O)CCNC(=O)c2nc(oc2C(F)(F)F)-c2c(Cl)cc(F)cc2Cl)cc1 \|r,wD:4.3,$;;;;;;;;;;;;;;HN;;;;;HN;;;;;;;;;;;;;;;;;;;;;;$,(14.27,-4.52,;12.93,-3.75,;12.93,-2.21,;11.6,-4.52,;10.27,-3.75,;10.27,-2.21,;8.93,-1.44,;7.6,-2.21,;7.6,-3.75,;8.93,-4.52,;6.27,-1.44,;4.93,-2.21,;3.6,-1.44,;3.6,.1,;2.26,.87,;.93,.1,;.93,-1.44,;-.4,.87,;-1.74,.1,;-3.07,.87,;-4.4,.1,;-4.4,-1.44,;-5.74,.87,;-7.2,.4,;-8.11,1.64,;-7.2,2.89,;-5.65,2.43,;-4.39,3.32,;-3.13,4.21,;-5.27,4.58,;-3.5,2.06,;-9.65,1.64,;-10.42,2.98,;-9.65,4.31,;-11.96,2.98,;-12.73,1.64,;-14.27,1.64,;-11.96,.31,;-10.42,.31,;-9.65,-1.02,;4.93,.87,;6.27,.1,)\|
BDBM351918	Nc1ncnc2OCCN(c3ccc4n(ccc4c3)-c3cccc(OC(F)(F)F)c3)C(=O)c12
BDBM351919	Nc1ncnc2OCCN(c3ccc4n(ccc4c3)C3CCC3)C(=O)c12
BDBM351920	CC(C)(C)n1ccc2cc(ccc12)N1CCOc2ncnc(N)c2C1=O
BDBM351921	Nc1ncnc2OCCN(c3ccc4n(ccc4c3)-c3ccccc3C(=O)C(F)(F)F)C(=O)c12
BDBM351924	Nc1ncnc2OCCN(c3ccc4n(ccc4c3)-c3ccccc3OC(F)F)C(=O)c12
BDBM351925	CC(C)COc1ccccc1-n1ccc2cc(ccc12)N1CCOc2ncnc(N)c2C1=O
BDBM351933	Cc1ccc(cn1)-n1ccc2cc(ccc12)N1CCOc2ncnc(N)c2C1=O
BDBM351950	Cc1ccc(cn1)-n1ccc2cc(cc(C3CC3)c12)N1CCOc2ncnc(N)c2C1=O
BDBM50239479	Clc1ccc(NC(=O)c2ccc3nc([nH]c3c2)-c2c(Cl)cccc2Cl)cc1
BDBM50239480	COc1ccc(cc1)-c1nnc(o1)-c1ccc2nc([nH]c2c1)-c1c(C)cc(CC(C)(C)C(O)=O)cc1C
BDBM50239481	COc1ccc(cc1)-c1nnc(o1)-c1ccc2nc([nH]c2c1)-c1c(C)cc(CCC(O)=O)cc1C
BDBM50239482	Cc1cc(CCC(O)=O)cc(C)c1-c1nc2ccc(cc2[nH]1)C(=O)Nc1ccc2ccccc2n1
BDBM50239483	Cc1cc(CC(C)(C)C(O)=O)cc(C)c1-c1nc2ccc(cc2[nH]1)C(=O)Nc1ccc2ccccc2n1
BDBM50239486	Clc1ccc(cc1)-c1nnc(o1)-c1ccc2nc([nH]c2c1)-c1c(Cl)cccc1Cl
BDBM50239484	COc1ccc(cc1)-c1nnc(o1)-c1ccc2nc([nH]c2c1)-c1c(Cl)cccc1Cl
BDBM50239485	Clc1ccc(cc1)-c1cnc(o1)-c1ccc2nc([nH]c2c1)-c1c(Cl)cccc1Cl
BDBM50260373	OC(=O)[C@@H]1CCCN1C(=O)c1ccc(cn1)-c1ccc(NC(=O)Nc2ccc(cc2)C(F)(F)F)cc1 \|r\|
BDBM50260374	COc1ccccc1NC(=O)Nc1ccc(cc1)-c1ccc(nc1)C(=O)N1CCC[C@H]1C(O)=O \|r\|
BDBM50260375	COc1cccc(NC(=O)Nc2ccc(cc2)-c2ccc(nc2)C(=O)N2CCC[C@H]2C(O)=O)c1 \|r\|
BDBM50260376	OC(=O)[C@@H]1CCCN1C(=O)c1ccc(cn1)-c1ccc(NC(=O)Nc2ccccc2Cl)cc1 \|r\|
BDBM50260377	OC(=O)[C@@H]1CCCN1C(=O)c1ccc(cn1)-c1ccc(NC(=O)Nc2cccc(Cl)c2)cc1 \|r\|
BDBM50260378	OC(=O)[C@@H]1CCCN1C(=O)c1ccc(cn1)-c1ccc(NC(=O)Nc2cccc(F)c2)cc1 \|r\|
BDBM50260379	OC(=O)[C@@H]1CCCN1C(=O)c1ccc(cn1)-c1ccc(NC(=O)Nc2ccccc2)cc1 \|r\|
BDBM50260380	OC(=O)[C@@H]1CCCN1C(=O)c1ccc(cn1)-c1ccc(NC(=O)Nc2cccc(c2)C(F)(F)F)cc1 \|r\|
BDBM50260382	OC(=O)[C@@H]1CCCN1C(=O)c1ccc(cn1)-c1ccc(NC(=O)Nc2ccc(Cl)cc2)cc1 \|r\|
BDBM50260371	OC(=O)[C@H]1CCCN1C(=O)c1ccc(cn1)-c1ccc(NC(=O)Nc2ccccc2)cc1 \|r\|
BDBM50260372	OC(=O)[C@@H]1CCCN1C(=O)c1ccc(cn1)-c1ccc(NC(=O)Nc2ccccc2C(F)(F)F)cc1 \|r\|
BDBM50260381	COc1ccc(NC(=O)Nc2ccc(cc2)-c2ccc(nc2)C(=O)N2CCC[C@H]2C(O)=O)cc1 \|r\|
BDBM50264732	FC(F)(F)c1ccc2[nH]c(nc2c1)-c1ccc(nc1)N1CCC2(CC1)NC(=O)N(C2=O)c1ccc(cc1)C#N
BDBM50264733	CS(=O)(=O)Nc1ccc2OC3(CCN(CC3)c3ccc(cn3)-c3nc4cc(ccc4[nH]3)C(F)(F)F)CC(=O)c2c1
BDBM50264792	Clc1ccc2[nH]c(nc2c1)-c1ccc(nc1)N1CCC2(CC1)OC(=O)c1ccncc21
BDBM50264793	Clc1ccc2[nH]c(nc2c1)-c1ccc(nc1)N1CCC2(CC1)OC(=O)c1ccccc21
BDBM50264795	FC(F)(F)c1ccc2[nH]c(nc2c1)-c1ccc(nc1)N1CCC(CC1)n1c2cccnc2[nH]c1=O
BDBM50264802	OC(=O)C1CCC2(CCN(CC2)c2ccc(cn2)-c2nc3cc(ccc3[nH]2)C(F)(F)F)CO1
BDBM50264803	OC(=O)CC1CCOC2(CCN(CC2)c2ccc(cn2)-c2nc3cc(ccc3[nH]2)C(F)(F)F)C1
BDBM50264804	OC(=O)CC1CCC2(CCN(CC2)c2ccc(cn2)-c2nc3cc(ccc3[nH]2)C(F)(F)F)OC1
BDBM50264805	OC(=O)CC1CCC2(CCN(CC2)c2ccc(cn2)-c2nc3cc(ccc3[nH]2)C(F)(F)F)O1
BDBM50264794	Cc1cccc(Cl)c1NC(=O)N1CCN(CC1)c1ccc(cn1)-c1nc2cc(ccc2[nH]1)C(F)(F)F
BDBM50264796	OC(=O)CN1CCC2(CC1)CCN(CC2)c1ccc(cn1)-c1nc2cc(ccc2[nH]1)C(F)(F)F
BDBM50264822	OC(=O)c1ccc2c(c1)C(=O)OC21CCN(CC1)c1ccc(cn1)-c1nc2cc(ccc2[nH]1)C(F)(F)F
BDBM50264823	Cc1cc2c(cc1Cl)C1(CCN(CC1)c1ccc(cn1)-c1nc3cc(ccc3[nH]1)C(F)(F)F)OC2(C)C(C)(C)C#N
BDBM50264824	FC(F)(F)c1ccc2[nH]c(nc2c1)-c1ccc(nc1)N1CCC2(CN(C(=O)O2)c2ccccc2)CC1
BDBM50264825	FC(F)(F)c1ccc2[nH]c(nc2c1)-c1ccc(nc1)N1CCC2(CC1)OC(=O)C=C2c1ccccc1 \|c:32\|
BDBM50264826	FC(F)(F)c1ccc2[nH]c(nc2c1)-c1ccc(nc1)N1CCC2(CC1)OC(Cc1cc(Cl)cc(Cl)c1)c1ccccc21
BDBM50264827	OC(=O)C1CC2(CCN(CC2)C2CCN(CC2)c2ccc(cn2)-c2nc3cc(ccc3[nH]2)C(F)(F)F)Oc2ccccc12
BDBM50264828	[H][C@]12CN(c3ccc(cn3)-c3nc4cc(Cl)ccc4[nH]3)[C@]([H])(CN1c1ccccc1)C2 \|r\|
BDBM50264829	OC(=O)[C@@H]1CCCC[C@H]1C1CCN(CC1)c1ccc(cn1)-c1nc2cc(ccc2[nH]1)C(F)(F)F \|r\|
BDBM50264840	Fc1ccc(CC2CC3(CCN(CC3)c3ccc(cn3)-c3nc4cc(ccc4[nH]3)C(F)(F)F)OC2=O)cc1
BDBM50264806	OC(=O)C[C@@H]1COC2(C1)CCN(CC2)c1ccc(cn1)-c1nc2cc(ccc2[nH]1)C(F)(F)F \|r\|
BDBM50264807	OC(=O)C[C@H]1COC2(C1)CCN(CC2)c1ccc(cn1)-c1nc2cc(ccc2[nH]1)C(F)(F)F \|r\|
BDBM50264808	OC(=O)C1CCC2(CCN(CC2)c2ccc(cn2)-c2nc3cc(ccc3[nH]2)C(F)(F)F)OC1
BDBM50264821	OC(=O)CC1COC2(C1)CCN(CC2)c1ccc(cn1)-c1nc2cc(ccc2[nH]1)C(F)(F)F
BDBM50265527	OC(=O)C1CC2(CCN(CC2)c2ccc(cn2)-c2nc3ccc(cc3[nH]2)C(F)(F)F)Oc2ccccc12
BDBM50264747	OC(C1CCN(CC1)c1ccc(cn1)-c1nc2cc(ccc2[nH]1)C(F)(F)F)c1cccnc1
BDBM50264757	Cc1nc2c(cc1Cl)C(OC21CCN(CC1)c1ccc(cn1)-c1nc2cc(ccc2[nH]1)C(F)(F)F)C(C)(C)c1ncnn1C
BDBM50264759	FC(F)(F)c1ccc2[nH]c(nc2c1)-c1ccc(nc1)N1CCN(CC1)C1CCS(=O)(=O)C1
BDBM50264758	FC(F)(F)c1ccc2[nH]c(nc2c1)-c1ccc(nc1)N1CCC2(CC1)OC(=O)Nc1ccccc21
BDBM50264769	FC(F)(F)c1ccc2[nH]c(nc2c1)-c1ccc(nc1)N1CCC2(CC1)OC(Cc1ccccc1)c1ccccc21
BDBM50264781	CC(=O)NC1(CCN(CC1)C1CCN(CC1)c1ccc(cn1)-c1nc2cc(ccc2[nH]1)C(F)(F)F)c1ccccc1
BDBM50264788	Cc1ccc2c(c1)C(CC(O)=O)CC21CCN(CC1)C1CCN(CC1)c1ccc(cn1)-c1nc2cc(ccc2[nH]1)C(F)(F)F
BDBM50264837	FC(F)(F)c1ccc2[nH]c(nc2c1)-c1ccc(nc1)N1CCC(CC1)c1ccccn1
BDBM50264838	FC(F)(F)c1ccc2[nH]c(nc2c1)-c1ccc(nc1)N1CCC2(CC1)OC(C1CC1)c1ccccc21
BDBM50264839	CC(C)CC1OC2(CCN(CC2)c2ccc(cn2)-c2nc3cc(ccc3[nH]2)C(F)(F)F)c2ccccc12
BDBM50264760	FC(F)(F)c1ccc2[nH]c(nc2c1)-c1ccc(nc1)N1CCC(CC1)(c1ccccc1)c1ccccc1
BDBM50264767	COc1ccc2[nH]cc(C3CCN(CC3)c3ccc(cn3)-c3nc4cc(ccc4[nH]3)C(F)(F)F)c2c1
BDBM50264768	Cc1cc2C(OC3(CCN(CC3)c3ccc(cn3)-c3nc4cc(ccc4[nH]3)C(F)(F)F)c2cc1Cl)C(C)(C)C#N
BDBM50264770	Fc1ccccc1CC1OC2(CCN(CC2)c2ccc(cn2)-c2nc3cc(ccc3[nH]2)C(F)(F)F)c2ccccc12
BDBM50264774	CS(=O)(=O)C1CCN(CC1)c1ccc(cn1)-c1nc2cc(ccc2[nH]1)C(F)(F)F
BDBM50264779	FC(F)(F)c1ccc2[nH]c(nc2c1)-c1ccc(nc1)N1CCC2(CC1)CNC(=O)c1ccccc21
BDBM50264780	CS(=O)(=O)N1CC2(CCN(CC2)c2ccc(cn2)-c2nc3cc(ccc3[nH]2)C(F)(F)F)c2ccccc12
BDBM50264782	OCCC1(CCN(CC1)c1ccc(cn1)-c1nc2cc(ccc2[nH]1)C(F)(F)F)c1ccccc1
BDBM50264783	OC(=O)CCC1(CCN(CC1)c1ccc(cn1)-c1nc2cc(ccc2[nH]1)C(F)(F)F)C1CCCCC1
BDBM50264784	Fc1cccc(CC2OC3(CCN(CC3)c3ccc(cn3)-c3nc4cc(ccc4[nH]3)C(F)(F)F)c3ccccc23)c1
BDBM50264785	OC(=O)C1CCC2(CC1)CCN(CC2)c1ccc(cn1)-c1nc2cc(ccc2[nH]1)C(F)(F)F
BDBM50264786	OC(=O)CC1CCC2(CC1)CCN(CC2)c1ccc(cn1)-c1nc2cc(ccc2[nH]1)C(F)(F)F
BDBM50264787	OC(=O)CCC1CCN(CC1)C1CCN(CC1)c1ccc(cn1)-c1nc2cc(ccc2[nH]1)C(F)(F)F
BDBM50264789	OC(=O)CCC1(CCN(CC1)C1CCN(CC1)c1ccc(cn1)-c1nc2cc(ccc2[nH]1)C(F)(F)F)c1ccc(Cl)cc1
BDBM50264790	Clc1ccc2[nH]c(nc2c1)-c1ccc(nc1)N1CCC2(CC1)OC(=O)c1cccnc21
BDBM50264791	Clc1ccc2[nH]c(nc2c1)-c1ccc(nc1)N1CCC2(CC1)OCc1ccccc21
BDBM50272089	Cc1cc(cc(C)c1C#CC(C)(C)CC(O)=O)N1CCOc2ncnc(N)c2C1=O
BDBM50272118	CC(C)(CC(O)=O)C#Cc1c(Cl)cc(cc1Cl)N1CCOc2ncnc(N)c2C1=O
BDBM50272119	CC(C)(CC(O)=O)C#Cc1ccc(cc1)N1CCOc2ncnc(N)c2C1=O
BDBM50272120	CC(C)(CC(O)=O)C#Cc1ccc(cc1Cl)N1CCOc2ncnc(N)c2C1=O
BDBM50272177	Cc1cc(cc(Cl)c1C#CC(C)(C)CC(O)=O)N1CCOc2ncnc(N)c2C1=O
BDBM50272178	Cc1cc(ccc1C#CC(C)(C)CC(O)=O)N1CCOc2ncnc(N)c2C1=O
BDBM395336	COc1ccc(cc1)-c1cn(COCC[Si](C)(C)C)c(n1)-c1ccc(cc1Cl)-c1cnc(OCC(C)(C)C)cc1C
BDBM395337	COC(=O)C[C@H]1CC[C@@H](CC1)c1ccc(cc1)-c1ccc(cn1)-c1ncc(n1COCC[Si](C)(C)C)C(F)(F)F \|r,wU:8.11,wD:5.4,(-13.86,-15.18,;-12.68,-16.17,;-11.35,-15.4,;-11.35,-13.86,;-10.02,-16.17,;-8.68,-15.4,;-7.35,-16.17,;-6.01,-15.4,;-6.01,-13.86,;-7.35,-13.09,;-8.68,-13.86,;-4.68,-13.09,;-4.68,-11.55,;-3.35,-10.78,;-2.01,-11.55,;-2.01,-13.09,;-3.35,-13.86,;-.68,-10.78,;-.68,-9.24,;.65,-8.47,;1.99,-9.24,;1.99,-10.78,;.65,-11.55,;3.32,-8.47,;3.32,-6.93,;4.79,-6.46,;5.81,-7.7,;4.79,-8.95,;5.56,-10.28,;7.1,-10.28,;7.87,-8.95,;9.41,-8.95,;10.18,-10.28,;10.95,-11.62,;8.84,-11.05,;11.51,-9.51,;7.35,-7.69,;8.89,-7.69,;7.34,-6.15,;8.59,-8.6,)\|
BDBM395338	OC(=O)C[C@H]1CCC[C@@H](C1)Oc1ccc(cc1)-c1ccc(cn1)-c1nc(c[nH]1)C(F)(F)F \|r\|
BDBM395340	CC(C)(C)OCCc1c[nH]c(n1)-c1ccc(nc1)-c1ccc(OCC(C)(C)C(O)=O)cc1
BDBM395360	OC(=O)Cc1cccc(OC2CCN(CC2)c2ccc(cn2)-c2nc(c[nH]2)C(F)(F)F)c1
BDBM395361	CCOC(=O)c1cccc(OCC2CCN(CC2)c2ccc(cc2)-c2nc(cn2COCC[Si](C)(C)C)C(F)(F)F)c1C
BDBM395362	CCOC(=O)C1CCC(CC1)c1ccc(cn1)-c1nc(cn1COCC[Si](C)(C)C)C(F)(F)F \|(3.93,-12.04,;4.36,-13.52,;5.89,-13.63,;6.52,-12.22,;8.05,-12.06,;5.61,-10.98,;6.24,-9.57,;5.33,-8.33,;3.8,-8.49,;3.18,-9.89,;4.08,-11.14,;2.9,-7.24,;3.52,-5.83,;2.62,-4.59,;1.09,-4.75,;.46,-6.16,;1.37,-7.4,;.18,-3.5,;.66,-2.04,;-.59,-1.13,;-1.83,-2.04,;-1.36,-3.5,;-2.26,-4.75,;-3.79,-4.59,;-4.7,-5.83,;-6.23,-5.67,;-6.86,-4.27,;-7.48,-2.86,;-5.45,-3.64,;-8.26,-4.89,;-.59,.41,;-.59,1.95,;-2.13,.41,;.95,.41,)\|
BDBM395363	Cc1ccc(OC[C@H]2CC[C@@H](CC2)c2ccc(cn2)-c2nc(c[nH]2)C(F)(F)F)cc1 \|r,wU:10.13,wD:7.6,(-9.79,-6.19,;-8.45,-5.42,;-8.5,-3.85,;-7.12,-3.11,;-5.79,-3.88,;-4.45,-3.11,;-3.12,-3.88,;-1.78,-3.11,;-.45,-3.88,;.88,-3.11,;.88,-1.57,;-.45,-.8,;-1.78,-1.57,;2.22,-.8,;2.22,.74,;3.55,1.51,;4.88,.74,;4.88,-.8,;3.55,-1.57,;6.22,1.51,;6.22,3.05,;7.7,3.56,;8.59,2.28,;7.68,1.03,;8.17,5.03,;8.65,6.49,;9.64,4.55,;6.71,5.5,;-5.79,-5.42,;-7.12,-6.19,)\|
BDBM395364	Fc1ccccc1OC[C@H]1CC[C@@H](CC1)c1ccc(cn1)-c1nc(c[nH]1)C(F)(F)F \|r,wU:12.16,wD:9.9,(-7.12,-1.57,;-7.12,-3.11,;-8.5,-3.85,;-8.45,-5.42,;-7.12,-6.19,;-5.79,-5.42,;-5.79,-3.88,;-4.45,-3.11,;-3.12,-3.88,;-1.78,-3.11,;-.45,-3.88,;.88,-3.11,;.88,-1.57,;-.45,-.8,;-1.78,-1.57,;2.22,-.8,;2.22,.74,;3.55,1.51,;4.88,.74,;4.88,-.8,;3.55,-1.57,;6.22,1.51,;6.22,3.05,;7.7,3.56,;8.59,2.28,;7.68,1.03,;8.17,5.03,;8.65,6.49,;9.64,4.55,;6.71,5.5,)\|
BDBM395341	CN(CC1COC(C)(C)O1)C(=O)C(C)(C)COc1ccc(cc1)-c1ccc(cn1)-c1nc(cn1Cc1ccccc1)C(F)(F)F
BDBM395342	CC(C)(COc1ccc(cc1)-c1ccc(cn1)-c1nc(Cl)c(Cl)[nH]1)C(O)=O
BDBM395343	COC(=O)C(C)(C)COc1ccc(cc1)-c1ccc(cn1)-c1nc(Cl)cn1COCC[Si](C)(C)C
BDBM395344	CCOCc1nc([nH]c1Cl)-c1ccc(nc1)-c1ccc(OCC(C)(C)C(O)=O)cc1
BDBM395345	Cc1cc(OCC(C)(C)C(O)=O)ncc1-c1ccc(cc1)-c1nc(c[nH]1)C#N
BDBM395346	C[Si](C)(C)CCOCn1cc(nc1-c1ccc(nc1)-c1ccc(OCc2ccccc2)cc1)C(=O)OCc1ccccc1
BDBM395365	Cc1ccnc(OC[C@H]2CC[C@@H](CC2)c2ccc(cn2)-c2nc(cn2COCC[Si](C)(C)C)C(F)(F)F)c1 \|r,wU:8.7,wD:11.14,(10.75,-5.86,;9.22,-6.02,;8.59,-7.43,;7.06,-7.59,;6.15,-6.34,;6.78,-4.94,;5.87,-3.69,;6.5,-2.29,;5.59,-1.04,;4.06,-1.2,;3.16,.05,;3.78,1.45,;5.32,1.61,;6.22,.37,;2.88,2.7,;3.51,4.11,;2.6,5.35,;1.07,5.19,;.44,3.78,;1.35,2.54,;.16,6.44,;.64,7.9,;-.61,8.81,;-1.85,7.9,;-1.38,6.44,;-2.28,5.19,;-3.81,5.35,;-4.72,4.11,;-6.25,4.27,;-7.15,3.02,;-8.06,1.77,;-8.4,3.93,;-5.91,2.12,;-.61,10.35,;-.61,11.89,;-2.15,10.35,;.93,10.35,;8.31,-4.78,)\|
BDBM395366	CCOC(=O)Cc1ccc(cc1)C1CCC(CC1)c1ccc(cn1)-c1nc(cn1COCC[Si](C)(C)C)C(F)(F)F \|w:9.12,(-7.25,-10.87,;-8.24,-9.69,;-9.69,-10.22,;-9.69,-11.76,;-11.03,-12.53,;-8.36,-12.53,;-8.36,-14.07,;-9.69,-14.84,;-9.69,-16.38,;-8.36,-17.15,;-7.02,-16.38,;-7.02,-14.84,;-8.36,-18.69,;-7.02,-19.46,;-7.02,-21,;-8.36,-21.77,;-9.69,-21,;-9.69,-19.46,;-8.36,-23.31,;-9.69,-24.08,;-9.69,-25.62,;-8.36,-26.39,;-7.02,-25.62,;-7.02,-24.08,;-8.36,-27.93,;-7.11,-28.84,;-7.59,-30.3,;-9.13,-30.3,;-9.6,-28.84,;-11.07,-28.36,;-11.39,-26.85,;-12.85,-26.38,;-14,-27.41,;-13.68,-28.92,;-13.36,-30.42,;-15.18,-29.24,;-12.17,-28.6,;-6.68,-31.55,;-5.78,-32.79,;-5.44,-30.64,;-7.93,-32.45,)\|
BDBM395367	C[Si](C)(C)CCOCn1cc(nc1-c1ccc(Br)nc1)C(F)(F)F
BDBM395368	COC(=O)C(C)(C)C(=O)OC(C)(C)C
BDBM395369	CCOC(=N)c1ccc(Cl)nc1
BDBM395370	COC[C@@]1(CC[C@@H](CC1)Oc1ccc(Br)cn1)C(=O)OC(C)(C)C \|r,wU:3.18,wD:6.9,3.2,(1.49,-2.47,;1.49,-4.01,;0,-4.41,;.4,-5.9,;1.73,-5.13,;3.07,-5.9,;3.07,-7.44,;1.73,-8.21,;.4,-7.44,;4.4,-8.21,;5.73,-7.44,;5.73,-5.9,;7.07,-5.13,;8.4,-5.9,;9.74,-5.13,;8.4,-7.44,;7.07,-8.21,;-1.09,-5.5,;-2.18,-6.59,;-1.86,-4.17,;-3.34,-3.77,;-4.43,-4.86,;-2.57,-2.43,;-3.74,-2.28,)\|
BDBM395371	COC[C@@]1(CC[C@@H](CC1)Oc1ccc(cn1)-c1ccc(cc1)-c1nnc([nH]1)C(F)(F)F)C(O)=O \|r,wU:6.9,3.2,wD:3.34,(-7.7,9.27,;-7.7,7.73,;-9.03,6.96,;-9.03,5.42,;-9.03,3.88,;-7.7,3.11,;-6.36,3.88,;-6.36,5.42,;-7.7,6.19,;-5.03,3.11,;-3.69,3.88,;-3.69,5.42,;-2.36,6.19,;-1.03,5.42,;-1.03,3.88,;-2.36,3.11,;.31,6.19,;1.64,5.42,;2.97,6.19,;2.97,7.73,;1.64,8.5,;.31,7.73,;4.31,8.5,;5.77,8.02,;6.68,9.27,;5.77,10.51,;4.31,10.04,;6.17,12,;5.08,13.09,;7.66,12.4,;7.26,10.91,;-10.36,6.19,;-11.7,5.42,;-10.36,7.73,)\|
BDBM395372	Brc1ccc(cc1)-c1nnc([nH]1)-c1ccccc1
BDBM395373	N=C(n1nnc2ccccc12)n1nnc2ccccc12
BDBM395374	Nc1nnc(o1)-c1ccc(Br)cc1
BDBM395375	CCOC(=O)[C@@H]1CC[C@@H](CC1)Oc1ccc(cn1)-c1ccc(cc1)-c1nc(OCC)n(COCC[Si](C)(C)C)n1 \|r,wU:5.4,8.11,(-4.28,-19,;-4.28,-20.54,;-5.61,-21.31,;-5.61,-22.85,;-6.95,-23.62,;-4.28,-23.62,;-4.28,-25.16,;-2.95,-25.93,;-1.61,-25.16,;-1.61,-23.62,;-2.95,-22.85,;-.28,-25.93,;1.06,-25.16,;1.06,-23.62,;2.39,-22.85,;3.72,-23.62,;3.72,-25.16,;2.39,-25.93,;5.06,-22.85,;6.39,-23.62,;7.72,-22.85,;7.72,-21.31,;6.39,-20.54,;5.06,-21.31,;9.06,-20.54,;9.06,-19,;10.52,-18.52,;10.92,-17.03,;12.41,-16.63,;12.81,-15.15,;11.43,-19.77,;12.91,-20.16,;13.31,-21.65,;12.22,-22.74,;10.74,-22.34,;9.65,-23.43,;10.05,-24.92,;9.25,-21.94,;8.16,-23.03,;10.52,-21.01,)\|
BDBM395376	NNC(=O)C1(CC1)C(F)(F)F
BDBM395377	CCCc1n[nH]c(n1)-c1ccc(cc1)-c1ccc(OCC(C)(C)C(=O)OC)nc1
BDBM395348	Cc1[nH]c(nc1C#N)-c1ccc(nc1)N1CCN(CC1)c1ccc(C)cc1
BDBM395347	FC(F)(F)c1cnc([nH]1)-c1ccc(nc1)N1CCN(CC1)C(=O)Cc1ccccc1Cl
BDBM395378	COC(=O)C(C)(C)COc1ccc(cn1)-c1ccc(cc1)-c1nc(n[nH]1)-c1ccc(OC)cc1
BDBM395379	COC(=O)C(C)(C)COc1ccc(cn1)-c1ccc(cc1)-c1nc(Oc2cccnc2)n(COCC[Si](C)(C)C)n1
BDBM395380	COC(=O)C(C)(C)COc1ccc(cn1)-c1ccc(cc1)-c1nc(Oc2ccc(cc2)C#N)n(COCC[Si](C)(C)C)n1
BDBM395381	COC(=O)C(C)(C)COc1ccc(cn1)-c1ccc(cc1)-c1nc(OCC(F)(F)C(F)(F)F)n(COCC[Si](C)(C)C)n1
BDBM395382	COC(=O)C(C)(C)COc1ccc(cn1)-c1ccc(cc1)-c1nc(Oc2cccc(C)n2)n(COCC[Si](C)(C)C)n1
BDBM395383	NC(=O)c1ccc(Br)cc1F
BDBM395384	[#6]-[#16]\[#6](-[#16]-[#6])=[#7]/[#6](=O)-c1ccc(Cl)nc1
BDBM395350	C[C@H]1CN(CCN1c1ccc(cn1)-c1nc(c[nH]1)C#N)c1ccc(C)c(F)c1 \|r\|
BDBM395349	Cc1ccc(cc1C)N1CCN(CC1)c1ccc(cn1)-c1nc(c[nH]1)C#N
BDBM395385	C[Si](C)(C)CCOCn1nc(nc1OCC(F)(F)F)-c1ccc(Br)cc1F
BDBM395386	C[Si](C)(C)CCOCn1nc(nc1Oc1ccc(F)cc1)-c1ccc(Br)cc1F
BDBM395387	COC(=O)C(C)(C)COc1ccc(cn1)B1OC(C)(C)C(C)(C)O1
BDBM395388	COC[C@@]1(CC[C@@H](CC1)Oc1ccc(cc1)-c1ccc(cn1)-c1nc(C)c(n1)C(F)(F)F)C(O)=O \|r,wU:6.9,3.2,wD:3.35,(-14.81,-2.24,;-14.04,-3.58,;-12.5,-3.58,;-11.73,-4.91,;-11.73,-6.45,;-10.4,-7.22,;-9.07,-6.45,;-9.07,-4.91,;-10.4,-4.14,;-7.73,-7.22,;-6.4,-6.45,;-6.4,-4.91,;-5.06,-4.14,;-3.73,-4.91,;-3.73,-6.45,;-5.06,-7.22,;-2.4,-4.14,;-2.4,-2.6,;-1.06,-1.83,;.27,-2.6,;.27,-4.14,;-1.06,-4.91,;1.6,-1.83,;3.13,-2.35,;4.01,-1.06,;5.55,-1.02,;3.07,.19,;1.6,-.29,;3.53,1.66,;2.48,2.79,;5.03,1.99,;4.57,.52,;-13.22,-5.31,;-13.62,-6.8,;-14.31,-4.22,)\|
BDBM50272121	COc1cc(ccc1C#CC(C)(C)CC(O)=O)N1CCOc2ncnc(N)c2C1=O
BDBM50272088	CC(=O)C[C@H]1CC[C@@H](CC1)c1ccc(cc1)N1CCOc2ncnc(N)c2C1=O \|r,wU:7.10,wD:4.3,(41.23,-28.2,;39.91,-28.98,;38.58,-28.22,;39.91,-30.51,;38.59,-31.28,;37.25,-30.52,;35.91,-31.3,;35.94,-32.83,;37.27,-33.6,;38.59,-32.82,;34.61,-33.61,;34.61,-35.16,;33.27,-35.93,;31.95,-35.16,;31.95,-33.62,;33.27,-32.84,;30.62,-35.93,;30.73,-37.45,;29.6,-38.51,;28.08,-38.29,;27.31,-36.95,;25.8,-37.19,;24.84,-35.99,;25.4,-34.56,;26.91,-34.33,;27.48,-32.89,;27.87,-35.52,;29.34,-35.06,;29.57,-33.54,)\|
BDBM50272102	Cc1cc(ccc1N1CCOc2ncnc(N)c2C1=O)C#CC(C)(C)CC(O)=O
BDBM50272164	COc1cc(cc(C)c1C#CC(C)(C)CC(O)=O)N1CCOc2ncnc(N)c2C1=O
BDBM50272165	CC(C)(CC(O)=O)C#Cc1ccc(cc1)[C@@H]1Oc2c(N)ncnc2OC1(C)C \|r\|
BDBM395308	CC(C)(COc1ccc(cc1)-c1ccc(cn1)-c1ncc([nH]1)-c1ccccc1)C(O)=O
BDBM395309	CC(C)(COc1ccc(cc1)-c1ccc(cn1)-c1ncc([nH]1)-c1cccc(F)c1)C(O)=O
BDBM395310	CC(C)(COc1ccc(cc1)-c1ccc(cn1)-c1ncc([nH]1)-c1ccccc1OCCCO)C(O)=O
BDBM395311	Cc1cccc(n1)-c1cnc([nH]1)-c1ccc(nc1)-c1ccc(OCC(C)(C)C(O)=O)cc1
BDBM395312	CC(C)(COc1ccc(cc1)-c1ccc(cn1)-c1ncc([nH]1)-c1ncccn1)C(O)=O
BDBM395351	Cc1ccc(cc1)N1CCN(CC1)c1ccc(cn1)-c1nc(c[nH]1)C1CCC1
BDBM395352	C[Si](C)(C)CCOCn1cc(nc1-c1ccc(nc1)N1CCN(CC1)c1ccc(CCO)cc1)C(F)(F)F
BDBM395353	CC1(C)OCC(COC(=O)Cc2ccc(cc2)N2CCN(CC2)c2ccc(cn2)-c2nc(c[nH]2)C(F)(F)F)O1
BDBM395354	CC(C)(CCN1CCN(CC1=O)c1ccc(cn1)-c1nc(c[nH]1)C(F)(F)F)C(=O)OCc1ccccc1
BDBM395313	CC(C)(COc1ccc(cc1)-c1ccc(cn1)-c1ncc([nH]1)-c1cccs1)C(O)=O
BDBM395314	CC(C)(COc1ccc(cc1)-c1ccc(cn1)-c1ncc([nH]1)-c1nccs1)C(O)=O
BDBM395315	Cc1cc(on1)-c1cnc([nH]1)-c1ccc(nc1)-c1ccc(OCC(C)(C)C(O)=O)cc1
BDBM395316	Cc1cc(ccc1-c1ncc([nH]1)-c1ccccc1)-c1ccc(OCC(C)(C)C(O)=O)nc1
BDBM395317	CC(C)(COc1ccc(cc1)-c1ccc(cn1)-c1ncc(CCOc2ccccc2)[nH]1)C(O)=O
BDBM395318	Cc1cc(OCC2(CC2)C(O)=O)ncc1-c1ccc(nc1)-c1ncc([nH]1)-c1ccccc1OC(F)(F)F
BDBM395356	OC(=O)Cc1ccc(cc1)C1CCN(CC1)c1ccc(cn1)-c1nc(c[nH]1)C(F)(F)F
BDBM395355	Cc1cccc(OCC2CCN(CC2)c2ccc(cn2)-c2nc(cn2COCC[Si](C)(C)C)C(F)(F)F)c1
BDBM395319	CC(C)Cc1ocnc1-c1cnc([nH]1)-c1ccc(nc1)-c1ccc(OCC(C)(C)C(O)=O)cc1
BDBM395320	CC(C)(COc1ccc(cn1)-c1ccc(cc1)-c1ncc([nH]1)-c1ccccc1)C([O-])=O
BDBM395321	COc1ccc(cc1)-c1cnc([nH]1)-c1ccc(cc1)-c1ccc(OCC(C)(C)C([O-])=O)nc1
BDBM395322	COc1ccc(cc1)-c1cnc([nH]1)-c1ccc(cc1)-c1cnc(OCC(C)(C)C([O-])=O)cc1C
BDBM395323	COc1nc([nH]c1-c1ccccc1)-c1ccc(nc1)-c1ccc(OCC(C)(C)C([O-])=O)cc1
BDBM395324	Cc1cc(OCC2(CC2)C(O)=O)ncc1-c1cnc(-c2ncc([nH]2)-c2ccccc2OC(F)(F)F)c(F)c1
BDBM395325	Cc1cc(OCC(C)(C)C(=O)OC(C)(C)C)ncc1-c1cnc(-c2ncc([nH]2)-c2ccccc2)c(F)c1
BDBM395326	Cc1cc(OCC2(CCC2)C(O)=O)ncc1-c1cnc(nc1)-c1ncc([nH]1)-c1ccccc1
BDBM395327	CCC(CC)(COc1cnc(cn1)-c1ccc(nc1)-c1ncc([nH]1)-c1ccccc1)C(O)=O
BDBM395328	Cc1cc(OCC(C)(C)C(O)=O)ncc1-c1cnc(nc1)-c1ncc([nH]1)-c1ccccc1C(F)(F)F
BDBM395329	COC(=O)C(C)(C)COc1ccc(cc1)-c1ccc(cn1)-c1nc(cn1COCC[Si](C)(C)C)-c1cccc(c1)C(=O)OCc1ccccc1
BDBM395330	COC(=O)C(C)(C)COc1ccc(cc1)-c1ccc(cn1)-c1nc(cn1COCC[Si](C)(C)C)-c1noc(C)n1
BDBM395358	CC(C)(CCC1CCN(CC1)c1ccc(cn1)-c1nc(c[nH]1)C(F)(F)F)C(O)=O
BDBM395357	CC(C)(COC1CCN(CC1)c1ccc(cn1)-c1nc(c[nH]1)C(F)(F)F)C(O)=O
BDBM395331	COC(=O)C[C@H]1CC[C@@H](CC1)c1ccc(cc1)-c1ccc(cn1)-c1nc(cn1COCC[Si](C)(C)C)-c1ccccc1 \|r,wU:8.11,wD:5.4,(-12.85,3.15,;-11.67,2.16,;-10.33,2.93,;-10.33,4.47,;-9,2.16,;-7.67,2.93,;-6.33,2.16,;-5,2.93,;-5,4.47,;-6.33,5.24,;-7.67,4.47,;-3.66,5.24,;-2.33,4.47,;-1,5.24,;-1,6.78,;-2.33,7.55,;-3.66,6.78,;.34,7.55,;.34,9.09,;1.67,9.86,;3,9.09,;3,7.55,;1.67,6.78,;4.34,9.86,;4.34,11.4,;5.8,11.88,;6.71,10.63,;5.8,9.39,;6.2,7.9,;5.11,6.81,;5.51,5.33,;4.42,4.24,;4.82,2.75,;3.73,1.66,;5.22,1.26,;6.64,2.75,;6.57,13.21,;8.11,13.21,;8.88,14.55,;8.11,15.88,;6.57,15.88,;5.8,14.55,)\|
BDBM395332	CC1(C)OB(OC1(C)C)c1ccc(nc1)-c1ccc(OCc2ccccc2)cc1
BDBM395333	COc1ccc(COc2ccc(cc2)-c2ccc(cn2)-c2nc(cn2COCC[Si](C)(C)C)C(=O)OCc2ccccc2)cc1
BDBM395334	CN(CC(O)CO)C(=O)C(C)(C)COc1ccc(cc1)-c1ccc(cn1)-c1ncc(-c2ccccc2)n1Cc1ccccc1
BDBM395335	COC(=O)C(C)(C)COc1ccc(cc1)-c1ccc(cn1)-c1nc(Cl)c([nH]1)-c1ccccc1
BDBM395359	OC(=O)c1cccc(OCC2CCN(CC2)c2ccc(cn2)-c2nc(c[nH]2)C(F)(F)F)c1Cl
BDBM50272166	CC(C)(CC(O)=O)C#Cc1ccc(cc1)C1Nc2c(N)ncnc2OC1(C)C
BDBM50272117	CCc1cc(cc(C)c1C#CC(C)(C)CC(O)=O)N1CCOc2ncnc(N)c2C1=O
BDBM50272122	CCc1cc(cc(CC)c1C#CC(C)(C)CC(O)=O)N1CCOc2ncnc(N)c2C1=O
BDBM50272139	CCc1cc(ccc1C#CC(C)(C)CC(O)=O)N1CCOc2ncnc(N)c2C1=O
BDBM50272140	Cc1cc(cc(F)c1C#CC(C)(C)CC(O)=O)N1CCOc2ncnc(N)c2C1=O
BDBM50272168	CC(C)(CC(O)=O)C#Cc1ccc(cc1F)N1CCOc2ncnc(N)c2C1=O
BDBM50272176	CC(C)(CC(O)=O)C#Cc1ccc(cc1C(F)(F)F)N1CCOc2ncnc(N)c2C1=O
BDBM50272104	CC(C)(CC(O)=O)C#Cc1ccc(cc1OC(F)(F)F)N1CCOc2ncnc(N)c2C1=O
BDBM50272116	CC(C)(CC(O)=O)C#Cc1ccc(cc1)-c1ccc(Nc2ccc(nc2)C(F)(F)F)cn1
BDBM50272167	CC(C)(CC(O)=O)C#Cc1ccc(cc1)C1=Nc2c(N)ncnc2OC1(C)C \|t:16\|
BDBM50287453	CCC1(CC(O)=O)CCc2cc(ccc2C1=O)-c1ccc(NC(=O)Nc2ccc(Cl)cc2)cc1
BDBM50287455	Cc1cccc(NC(=O)Nc2ccc(cc2)-c2ccc3C(=O)C(C)(CC(O)=O)CCc3c2)c1
BDBM50287456	CC1(CC(O)=O)CCc2cc(ccc2C1=O)-c1ccc(NC(=O)Nc2cccc(Cl)c2)cc1
BDBM50287457	CC1(CC(O)=O)CCc2cc(ccc2C1=O)-c1ccc(NC(=O)Nc2cccc(F)c2)cc1
BDBM50287458	CC[C@@]1(CC(O)=O)CCc2cc(ccc2C1=O)-c1ccc(NC(=O)Nc2ccc(F)c(F)c2)cc1Cl \|r\|
BDBM50287459	CC[C@@]1(CC(O)=O)CCc2cc(ccc2C1=O)-c1ccc(NC(=O)Nc2cccc(c2)C(F)(F)F)cc1Cl \|r\|
BDBM50461581	Cc1nc(C)c(nc1C(N)=O)-c1ccc(cc1)-c1ccc(CC(O)=O)cc1Cl
BDBM50287311	CC[C@@]1(CC(O)=O)CCc2cc(ccc2C1=O)-c1ccc(NC(=O)Nc2cccc(c2)C(F)(F)F)cc1 \|r\|
BDBM50287312	OC(=O)CC1CCc2cc(ccc2C1=O)-c1ccc(NC(=O)Nc2ccccc2)cc1
BDBM50287314	CCC1(CC(O)=O)CCc2cc(ccc2C1=O)-c1ccc(NC(=O)Nc2ccc(cc2)C(F)(F)F)cc1
BDBM50287315	CCC1(CC(O)=O)CCc2cc(ccc2C1=O)-c1ccc(NC(=O)Nc2ccccc2C(F)(F)F)cc1
BDBM50287320	CC[C@]1(CC(O)=O)CCc2cc(ccc2C1=O)-c1ccc(NC(=O)Nc2cccc(c2)C(F)(F)F)cc1 \|r\|
BDBM50287329	OC(=O)C[C@]1(CC(F)(F)F)CCc2cc(ccc2C1=O)-c1cnc(NC(=O)Nc2cccc(c2)C(F)(F)F)cn1 \|r\|
BDBM50287330	CC[C@]1(CC(O)=O)CCc2cc(ccc2C1=O)-c1ccc(NC(=O)Nc2ccc(Cl)cc2)cc1 \|r\|
BDBM50287387	CCC1(CC(O)=O)CCc2cc(ccc2C1=O)-c1ccc(NC(=O)Nc2ccccc2)cc1
BDBM50287388	CC1(CC(O)=O)CCc2cc(ccc2C1=O)-c1ccc(NC(=O)Nc2cccc(c2)C(F)(F)F)cc1
BDBM50287389	CC[C@@]1(CC(O)=O)CCc2cc(ccc2C1=O)-c1ccc(NC(=O)Nc2ccc(Cl)cc2)cc1 \|r\|
BDBM50287446	OC(=O)CC1CCc2cc(ccc2C1)-c1ccc(NC(=O)Nc2ccccc2)cc1
BDBM50287447	CC1(CC(O)=O)CCc2cc(ccc2C1=O)-c1ccc(NC(=O)Nc2ccccc2)cc1
BDBM50287448	CCCC1(CC(O)=O)CCc2cc(ccc2C1=O)-c1ccc(NC(=O)Nc2ccccc2)cc1
BDBM50287450	CCC1(CC(O)=O)CCc2cc(ccc2C1=O)-c1ccc(NC(=O)Nc2cccc(C)c2)cc1
BDBM50287451	CCC1(CC(O)=O)CCc2cc(ccc2C1=O)-c1ccc(NC(=O)Nc2cccc(Cl)c2)cc1
BDBM411430	FC(F)(F)Oc1cccc(c1)-n1ccc2cc(ccc12)N1CCOc2ncnc(Cl)c2C1=O
BDBM411434	Cn1cc(ccc1=O)-n1ccc2cc(cnc12)N1CCOc2ncnc(N)c2C1=O
BDBM411435	CCc1ncc(cn1)-n1ccc2cc(cnc12)N1CCOc2ncnc(N)c2C1=O
BDBM411436	CC(C)(O)Cn1ccc2cc(cnc12)N1CCOc2ncnc(N)c2C1=O
BDBM411440	COc1ccccc1-n1ccc2cc(ccc12)N1CCOc2ncnc(N)c2C1=O
BDBM411446	Nc1ncnc2OCCN(c3cnc4n(ccc4c3)-c3cccc(OC4CCCC4)c3)C(=O)c12
BDBM411447	CCc1nc(C)ccc1-n1ccc2cc(ccc12)N1CCOc2ncnc(N)c2C1=O
BDBM411458	COc1ccccc1-n1ccc2cc(cc(NC(=O)C3CC3)c12)N1CCOc2ncnc(Cl)c2C1=O
BDBM411459	Cc1nnc([nH]1)-n1ccc2cc(ccc12)N1CCOc2ncnc(Cl)c2C1=O
BDBM411460	Clc1cccc(c1Cl)-n1ccc2cc(ccc12)N1CCOc2ncnc(Cl)c2C1=O
BDBM411461	CC(C)n1ccc2cc(cc(N3CCOCC3)c12)N1CCOc2ncnc(Cl)c2C1=O
BDBM411462	COc1cccc(c1Br)-n1ccc2cc(ccc12)N1CCOc2ncnc(Cl)c2C1=O
BDBM50287308	CCC1(CC(O)=O)CCc2cc(ccc2C1=O)-c1ccc(NC(=O)Nc2cccc(OC)c2)cc1
BDBM50287309	COc1cccc(NC(=O)Nc2ccc(cc2)-c2ccc3C(=O)C(C)(CC(O)=O)CCc3c2)c1
BDBM50287310	OC(=O)C[C@]1(CC(F)(F)F)CCc2cc(ccc2C1=O)-c1cnc(NC(=O)Nc2ccc(F)c(F)c2)cn1 \|r\|
BDBM50287313	CCC1(CC(O)=O)CCc2cc(ccc2C1=O)-c1ccc(NC(=O)Nc2cccc(c2)C(F)(F)F)cc1
BDBM50287449	OC(=O)CC1(CC(F)(F)F)CCc2cc(ccc2C1=O)-c1ccc(NC(=O)Nc2ccccc2)cc1
BDBM50287452	CCC1(CC(O)=O)CCc2cc(ccc2C1=O)-c1ccc(NC(=O)Nc2cccc(F)c2)cc1
BDBM50461583	Cc1nc(C)c(nc1C(N)=O)-c1ccc(c(Cl)c1)-c1ccc(CC(O)=O)cc1
BDBM50461584	Cc1nc(C)c(nc1C(N)=O)-c1ccc(cc1)-c1ccc(CC(O)=O)cc1
BDBM50461587	C[C@H](C(O)=O)c1ccc(c(Cl)c1)-c1ccc(cc1F)-c1nc(C(N)=O)c(C)nc1C \|r\|
BDBM50287454	CCC1(CC(O)=O)CCc2cc(ccc2C1=O)-c1ccc(NC(=O)Nc2ccc(C)cc2)cc1
BDBM50499964	OC(=O)[C@H]1CC[C@@H](CC1)Oc1ccc(cc1)C(=O)Nc1nnc(Cc2cc(F)cc(F)c2)s1 \|r,wU:6.9,wD:3.2,(-9.07,-.95,;-8,-1.56,;-7.99,-2.79,;-6.67,-.78,;-5.33,-1.55,;-4,-.77,;-4,.77,;-5.34,1.53,;-6.67,.76,;-2.67,1.54,;-1.33,.77,;,1.54,;1.33,.77,;1.33,-.77,;,-1.54,;-1.33,-.77,;2.67,-1.54,;3.73,-.93,;2.66,-3.08,;4,-3.86,;4.14,-5.38,;5.64,-5.7,;6.41,-4.36,;7.94,-4.2,;8.57,-2.79,;10.1,-2.63,;10.72,-1.22,;11.95,-1.08,;9.81,.03,;8.28,-.14,;7.55,.85,;7.66,-1.55,;5.38,-3.22,)\|
BDBM50499965	OC(=O)[C@@H]1CC[C@@H](CC1)Oc1ccc(cn1)C(=O)Nc1nnc(Cc2cccc(Cl)c2)s1 \|r,wU:6.9,3.2,(-9.07,-.95,;-8,-1.56,;-7.99,-2.79,;-6.67,-.78,;-5.33,-1.55,;-4,-.77,;-4,.77,;-5.34,1.53,;-6.67,.76,;-2.67,1.54,;-1.33,.77,;,1.54,;1.33,.77,;1.33,-.77,;,-1.54,;-1.33,-.77,;2.67,-1.54,;3.73,-.93,;2.66,-3.08,;4,-3.86,;4.14,-5.38,;5.64,-5.7,;6.41,-4.36,;7.94,-4.2,;8.57,-2.79,;10.1,-2.63,;10.72,-1.22,;9.81,.03,;8.28,-.14,;7.55,.85,;7.66,-1.55,;5.38,-3.22,)\|
BDBM50499966	OC(=O)[C@@H]1CC[C@@H](CC1)Oc1ccc(cc1)C(=O)Nc1nnc(NC2CCCC2)s1 \|r,wU:6.9,3.2,(-9.07,-.95,;-8,-1.56,;-7.99,-2.79,;-6.67,-.78,;-5.33,-1.55,;-4,-.77,;-4,.77,;-5.34,1.53,;-6.67,.76,;-2.67,1.54,;-1.33,.77,;,1.54,;1.33,.77,;1.33,-.77,;,-1.54,;-1.33,-.77,;2.67,-1.54,;3.73,-.93,;2.66,-3.08,;4,-3.86,;4.14,-5.38,;5.65,-5.7,;6.42,-4.36,;7.94,-4.2,;8.57,-2.79,;10.07,-2.49,;10.22,-.95,;8.81,-.33,;7.79,-1.48,;5.38,-3.22,)\|
BDBM50499967	OC(=O)C[C@H]1CC[C@@H](CC1)c1ccc(cc1)C(=O)Nc1nnc(CCC2CCCO2)s1 \|r,wU:7.10,wD:4.3,(-5.61,6,;-6.67,5.39,;-7.74,6,;-6.67,3.85,;-5.34,3.08,;-5.34,1.54,;-4,.77,;-2.67,1.54,;-2.67,3.08,;-4.01,3.85,;-1.33,.77,;,1.54,;1.33,.77,;1.33,-.77,;,-1.54,;-1.33,-.77,;2.67,-1.54,;3.73,-.93,;2.66,-3.08,;4,-3.86,;4.14,-5.38,;5.65,-5.7,;6.42,-4.36,;7.94,-4.2,;8.57,-2.79,;10.1,-2.63,;11.11,-3.77,;12.52,-3.15,;12.36,-1.62,;10.85,-1.3,;5.38,-3.22,)\|
BDBM50499968	OC(=O)C[C@H]1CC[C@@H](CC1)c1ccc(cc1)C(=O)Nc1nnc(CCC2CCOC2)s1 \|r,wU:7.10,wD:4.3,(-5.61,6,;-6.67,5.39,;-7.74,6,;-6.67,3.85,;-5.34,3.08,;-5.34,1.54,;-4,.77,;-2.67,1.54,;-2.67,3.08,;-4.01,3.85,;-1.33,.77,;,1.54,;1.33,.77,;1.33,-.77,;,-1.54,;-1.33,-.77,;2.67,-1.54,;3.73,-.93,;2.66,-3.08,;4,-3.86,;4.14,-5.38,;5.65,-5.7,;6.42,-4.36,;7.94,-4.2,;8.57,-2.79,;10.1,-2.63,;11.11,-3.77,;12.52,-3.15,;12.36,-1.62,;10.85,-1.3,;5.38,-3.22,)\|
BDBM50499969	OC(=O)[C@@H]1CC[C@@H](CC1)Oc1ccc(cc1)C(=O)Nc1nnc(Cc2cc(F)cc(F)c2)s1 \|r,wU:6.9,3.2,(-9.07,-.95,;-8,-1.56,;-7.99,-2.79,;-6.67,-.78,;-5.33,-1.55,;-4,-.77,;-4,.77,;-5.34,1.53,;-6.67,.76,;-2.67,1.54,;-1.33,.77,;,1.54,;1.33,.77,;1.33,-.77,;,-1.54,;-1.33,-.77,;2.67,-1.54,;3.73,-.93,;2.66,-3.08,;4,-3.86,;4.14,-5.38,;5.64,-5.7,;6.41,-4.36,;7.94,-4.2,;8.57,-2.79,;10.1,-2.63,;10.72,-1.22,;11.95,-1.08,;9.81,.03,;8.28,-.14,;7.55,.85,;7.66,-1.55,;5.38,-3.22,)\|
BDBM50499970	OC(=O)[C@@H]1CC[C@@H](CC1)Oc1ccc(cc1)C(=O)Nc1nnc(Nc2ccccc2)s1 \|r,wU:6.9,3.2,(-9.07,-.95,;-8,-1.56,;-7.99,-2.79,;-6.67,-.78,;-5.33,-1.55,;-4,-.77,;-4,.77,;-5.34,1.53,;-6.67,.76,;-2.67,1.54,;-1.33,.77,;,1.54,;1.33,.77,;1.33,-.77,;,-1.54,;-1.33,-.77,;2.67,-1.54,;3.73,-.93,;2.66,-3.08,;4,-3.86,;4.14,-5.38,;5.64,-5.7,;6.41,-4.36,;7.94,-4.2,;8.57,-2.79,;10.1,-2.63,;10.72,-1.22,;9.81,.03,;8.28,-.14,;7.66,-1.55,;5.38,-3.22,)\|
BDBM50499285	COc1cccc(c1)-c1ccc(CNC(=O)Nc2cccc(Cl)c2Cl)c2cnccc12
BDBM50499971	OC(=O)C[C@H]1CC[C@@H](CC1)c1ccc(cc1)C(=O)Nc1nnc(Cc2ccc(F)cc2)o1 \|r,wU:7.10,wD:4.3,(-5.61,6,;-6.67,5.39,;-7.74,6,;-6.67,3.85,;-5.34,3.08,;-5.34,1.54,;-4,.77,;-2.67,1.54,;-2.67,3.08,;-4.01,3.85,;-1.33,.77,;,1.54,;1.33,.77,;1.33,-.77,;,-1.54,;-1.33,-.77,;2.67,-1.54,;3.73,-.93,;2.66,-3.08,;4,-3.86,;4.14,-5.38,;5.65,-5.7,;6.42,-4.36,;7.94,-4.2,;8.57,-2.79,;10.1,-2.63,;10.72,-1.22,;9.81,.03,;10.31,1.15,;8.28,-.14,;7.66,-1.55,;5.38,-3.22,)\|
BDBM50499972	OC(=O)C[C@H]1CC[C@@H](CC1)c1ccc(cc1)C(=O)Nc1noc(Cc2ccccc2)n1 \|r,wU:7.10,wD:4.3,(-5.61,6,;-6.67,5.39,;-7.74,6,;-6.67,3.85,;-5.34,3.08,;-5.34,1.54,;-4,.77,;-2.67,1.54,;-2.67,3.08,;-4.01,3.85,;-1.33,.77,;,1.54,;1.33,.77,;1.33,-.77,;,-1.54,;-1.33,-.77,;2.67,-1.54,;3.73,-.93,;2.66,-3.08,;4,-3.86,;4.14,-5.38,;5.65,-5.7,;6.42,-4.36,;7.94,-4.2,;8.57,-2.79,;10.1,-2.63,;10.72,-1.22,;9.81,.03,;8.28,-.14,;7.66,-1.55,;5.38,-3.22,)\|
BDBM50499973	OC(=O)[C@@H]1CC[C@@H](CC1)Oc1ccc(cc1)C(=O)Nc1nc(Cc2ccccc2)no1 \|r,wU:6.9,3.2,(-9.07,-.95,;-8,-1.56,;-7.99,-2.79,;-6.67,-.78,;-5.33,-1.55,;-4,-.77,;-4,.77,;-5.34,1.53,;-6.67,.76,;-2.67,1.54,;-1.33,.77,;,1.54,;1.33,.77,;1.33,-.77,;,-1.54,;-1.33,-.77,;2.67,-1.54,;3.73,-.93,;2.66,-3.08,;4,-3.86,;5.38,-3.22,;6.41,-4.36,;7.94,-4.2,;8.57,-2.79,;10.1,-2.63,;10.72,-1.22,;9.81,.03,;8.28,-.14,;7.66,-1.55,;5.64,-5.7,;4.14,-5.38,)\|
BDBM50499974	NC(=O)C[C@H]1CC[C@@H](CC1)c1ccc(cc1)C(=O)Nc1nnc(Cc2ccccc2)s1 \|r,wU:7.10,wD:4.3,(-5.61,6,;-6.67,5.39,;-7.74,6,;-6.67,3.85,;-5.34,3.08,;-5.34,1.54,;-4,.77,;-2.67,1.54,;-2.67,3.08,;-4.01,3.85,;-1.33,.77,;,1.54,;1.33,.77,;1.33,-.77,;,-1.54,;-1.33,-.77,;2.67,-1.54,;3.73,-.93,;2.66,-3.08,;4,-3.86,;4.14,-5.38,;5.65,-5.7,;6.42,-4.36,;7.94,-4.2,;8.57,-2.79,;10.1,-2.63,;10.72,-1.22,;9.81,.03,;8.28,-.14,;7.66,-1.55,;5.38,-3.22,)\|
BDBM50499975	CC(C)(O)CNC(=O)C[C@H]1CC[C@@H](CC1)c1ccc(cc1)C(=O)Nc1nnc(Cc2ccccc2)s1 \|r,wU:12.15,wD:9.8,(-10.41,9.09,;-9.34,8.47,;-10.41,7.86,;-9.34,9.7,;-8.01,7.7,;-8.01,6.16,;-6.67,5.39,;-5.61,6,;-6.67,3.85,;-5.34,3.08,;-5.34,1.54,;-4,.77,;-2.67,1.54,;-2.67,3.08,;-4.01,3.85,;-1.33,.77,;,1.54,;1.33,.77,;1.33,-.77,;,-1.54,;-1.33,-.77,;2.67,-1.54,;3.73,-.93,;2.66,-3.08,;4,-3.86,;4.14,-5.38,;5.65,-5.7,;6.42,-4.36,;7.94,-4.2,;8.57,-2.79,;10.1,-2.63,;10.72,-1.22,;9.81,.03,;8.28,-.14,;7.66,-1.55,;5.38,-3.22,)\|
BDBM50499290	Cc1noc(n1)[C@H]1C[C@@H]1C(=O)NCc1ccc(-c2cccc(OC(F)(F)F)c2)c2CCN(Cc12)C(=O)NC(C)(C)C \|r\|
BDBM50499976	OC(=O)C[C@H]1CC[C@@H](CC1)c1ccc(cc1)C(=O)Nc1nnc(COC2CCCC2)s1 \|r,wU:7.10,wD:4.3,(-5.61,6,;-6.67,5.39,;-7.74,6,;-6.67,3.85,;-5.34,3.08,;-5.34,1.54,;-4,.77,;-2.67,1.54,;-2.67,3.08,;-4.01,3.85,;-1.33,.77,;,1.54,;1.33,.77,;1.33,-.77,;,-1.54,;-1.33,-.77,;2.67,-1.54,;3.73,-.93,;2.66,-3.08,;4,-3.86,;4.14,-5.38,;5.65,-5.7,;6.42,-4.36,;7.94,-4.2,;8.57,-2.79,;10.1,-2.63,;10.85,-1.3,;12.36,-1.62,;12.52,-3.15,;11.11,-3.77,;5.38,-3.22,)\|
BDBM50499977	COCCNC(=O)C[C@H]1CC[C@@H](CC1)c1ccc(cc1)C(=O)Nc1nnc(Cc2ccccc2)s1 \|r,wU:11.14,wD:8.7,(-10.41,10.63,;-9.34,10.01,;-9.34,8.47,;-8.01,7.7,;-8.01,6.16,;-6.67,5.39,;-5.61,6,;-6.67,3.85,;-5.34,3.08,;-5.34,1.54,;-4,.77,;-2.67,1.54,;-2.67,3.08,;-4.01,3.85,;-1.33,.77,;,1.54,;1.33,.77,;1.33,-.77,;,-1.54,;-1.33,-.77,;2.67,-1.54,;3.73,-.93,;2.66,-3.08,;4,-3.86,;4.14,-5.38,;5.65,-5.7,;6.42,-4.36,;7.94,-4.2,;8.57,-2.79,;10.1,-2.63,;10.72,-1.22,;9.81,.03,;8.28,-.14,;7.66,-1.55,;5.38,-3.22,)\|
BDBM50499978	OC(=O)[C@@H]1CC[C@@H](CC1)Oc1ccc(cc1)C(=O)Nc1nnc(Cc2ccccc2)s1 \|r,wU:6.9,3.2,(-9.07,-.95,;-8,-1.56,;-7.99,-2.79,;-6.67,-.78,;-5.33,-1.55,;-4,-.77,;-4,.77,;-5.34,1.53,;-6.67,.76,;-2.67,1.54,;-1.33,.77,;,1.54,;1.33,.77,;1.33,-.77,;,-1.54,;-1.33,-.77,;2.67,-1.54,;3.73,-.93,;2.66,-3.08,;4,-3.86,;4.14,-5.38,;5.64,-5.7,;6.41,-4.36,;7.94,-4.2,;8.57,-2.79,;10.1,-2.63,;10.72,-1.22,;9.81,.03,;8.28,-.14,;7.66,-1.55,;5.38,-3.22,)\|
BDBM50499979	OC(=O)[C@@H]1CC[C@@H](CC1)Oc1ccc(cc1)C(=O)Nc1nc(Cc2cc(F)cc(F)c2)no1 \|r,wU:6.9,3.2,(-9.07,-.95,;-8,-1.56,;-7.99,-2.79,;-6.67,-.78,;-5.33,-1.55,;-4,-.77,;-4,.77,;-5.34,1.53,;-6.67,.76,;-2.67,1.54,;-1.33,.77,;,1.54,;1.33,.77,;1.33,-.77,;,-1.54,;-1.33,-.77,;2.67,-1.54,;3.73,-.93,;2.66,-3.08,;4,-3.86,;5.38,-3.22,;6.41,-4.36,;7.94,-4.2,;8.57,-2.79,;10.1,-2.63,;10.72,-1.22,;11.95,-1.08,;9.81,.03,;8.28,-.14,;7.55,.85,;7.66,-1.55,;5.64,-5.7,;4.14,-5.38,)\|
BDBM50499980	OC(=O)C[C@H]1CC[C@@H](CC1)c1ccc(cc1)C(=O)Nc1nc(Cc2ccccc2)no1 \|r,wU:7.10,wD:4.3,(-5.61,6,;-6.67,5.39,;-7.74,6,;-6.67,3.85,;-5.34,3.08,;-5.34,1.54,;-4,.77,;-2.67,1.54,;-2.67,3.08,;-4.01,3.85,;-1.33,.77,;,1.54,;1.33,.77,;1.33,-.77,;,-1.54,;-1.33,-.77,;2.67,-1.54,;3.73,-.93,;2.66,-3.08,;4,-3.86,;5.38,-3.22,;6.42,-4.36,;7.94,-4.2,;8.57,-2.79,;10.1,-2.63,;10.72,-1.22,;9.81,.03,;8.28,-.14,;7.66,-1.55,;5.65,-5.7,;4.14,-5.38,)\|
BDBM50499981	O=C(C[C@H]1CC[C@@H](CC1)c1ccc(cc1)C(=O)Nc1nnc(Cc2ccccc2)s1)NCCN1CCOCC1 \|r,wU:6.9,wD:3.2,(-5.61,6,;-6.67,5.39,;-6.67,3.85,;-5.34,3.08,;-5.34,1.54,;-4,.77,;-2.67,1.54,;-2.67,3.08,;-4.01,3.85,;-1.33,.77,;,1.54,;1.33,.77,;1.33,-.77,;,-1.54,;-1.33,-.77,;2.67,-1.54,;3.73,-.93,;2.66,-3.08,;4,-3.86,;4.14,-5.38,;5.65,-5.7,;6.42,-4.36,;7.94,-4.2,;8.57,-2.79,;10.1,-2.63,;10.72,-1.22,;9.81,.03,;8.28,-.14,;7.66,-1.55,;5.38,-3.22,;-8.01,6.16,;-8.01,7.7,;-9.34,8.47,;-9.34,10.01,;-10.67,10.78,;-10.67,12.32,;-9.34,13.09,;-8,12.32,;-8.01,10.78,)\|
BDBM50499982	OC(=O)[C@@H]1CC[C@@H](CC1)Oc1ccc(cn1)C(=O)Nc1nnc(Cc2ccccc2)s1 \|r,wU:6.9,3.2,(-9.07,-.95,;-8,-1.56,;-7.99,-2.79,;-6.67,-.78,;-5.33,-1.55,;-4,-.77,;-4,.77,;-5.34,1.53,;-6.67,.76,;-2.67,1.54,;-1.33,.77,;,1.54,;1.33,.77,;1.33,-.77,;,-1.54,;-1.33,-.77,;2.67,-1.54,;3.73,-.93,;2.66,-3.08,;4,-3.86,;4.14,-5.38,;5.64,-5.7,;6.41,-4.36,;7.94,-4.2,;8.57,-2.79,;10.1,-2.63,;10.72,-1.22,;9.81,.03,;8.28,-.14,;7.66,-1.55,;5.38,-3.22,)\|
BDBM50499983	OC(=O)[C@H]1CC[C@@H](CC1)Oc1ccc(cc1)C(=O)Nc1nnc(Cc2ccccc2)s1 \|r,wU:6.9,wD:3.2,(-9.07,-.95,;-8,-1.56,;-7.99,-2.79,;-6.67,-.78,;-5.33,-1.55,;-4,-.77,;-4,.77,;-5.34,1.53,;-6.67,.76,;-2.67,1.54,;-1.33,.77,;,1.54,;1.33,.77,;1.33,-.77,;,-1.54,;-1.33,-.77,;2.67,-1.54,;3.73,-.93,;2.66,-3.08,;4,-3.86,;4.14,-5.38,;5.64,-5.7,;6.41,-4.36,;7.94,-4.2,;8.57,-2.79,;10.1,-2.63,;10.72,-1.22,;9.81,.03,;8.28,-.14,;7.66,-1.55,;5.38,-3.22,)\|
BDBM50499984	OC(=O)[C@@H]1CC[C@@H](CC1)Oc1ccc(cc1)C(=O)Nc1nnc(COC2CCCC2)s1 \|r,wU:6.9,3.2,(-9.07,-.95,;-8,-1.56,;-7.99,-2.79,;-6.67,-.78,;-5.33,-1.55,;-4,-.77,;-4,.77,;-5.34,1.53,;-6.67,.76,;-2.67,1.54,;-1.33,.77,;,1.54,;1.33,.77,;1.33,-.77,;,-1.54,;-1.33,-.77,;2.67,-1.54,;3.73,-.93,;2.66,-3.08,;4,-3.86,;4.14,-5.38,;5.65,-5.7,;6.42,-4.36,;7.94,-4.2,;8.57,-2.79,;10.1,-2.63,;10.85,-1.3,;12.36,-1.62,;12.52,-3.15,;11.11,-3.77,;5.38,-3.22,)\|
BDBM50499985	OCC(O)CNC(=O)C[C@H]1CC[C@@H](CC1)c1ccc(cc1)C(=O)Nc1nnc(Cc2ccccc2)s1 \|r,wU:12.15,wD:9.8,(-10.41,10.63,;-9.34,10.01,;-9.34,8.47,;-10.41,7.86,;-8.01,7.7,;-8.01,6.16,;-6.67,5.39,;-5.61,6,;-6.67,3.85,;-5.34,3.08,;-5.34,1.54,;-4,.77,;-2.67,1.54,;-2.67,3.08,;-4.01,3.85,;-1.33,.77,;,1.54,;1.33,.77,;1.33,-.77,;,-1.54,;-1.33,-.77,;2.67,-1.54,;3.73,-.93,;2.66,-3.08,;4,-3.86,;4.14,-5.38,;5.65,-5.7,;6.42,-4.36,;7.94,-4.2,;8.57,-2.79,;10.1,-2.63,;10.72,-1.22,;9.81,.03,;8.28,-.14,;7.66,-1.55,;5.38,-3.22,)\|
BDBM50499986	CN(C)CCNC(=O)C[C@H]1CC[C@@H](CC1)c1ccc(cc1)C(=O)Nc1nnc(Cc2ccccc2)s1 \|r,wU:12.15,wD:9.8,(-10.41,10.63,;-9.34,10.01,;-8.27,10.63,;-9.34,8.47,;-8.01,7.7,;-8.01,6.16,;-6.67,5.39,;-5.61,6,;-6.67,3.85,;-5.34,3.08,;-5.34,1.54,;-4,.77,;-2.67,1.54,;-2.67,3.08,;-4.01,3.85,;-1.33,.77,;,1.54,;1.33,.77,;1.33,-.77,;,-1.54,;-1.33,-.77,;2.67,-1.54,;3.73,-.93,;2.66,-3.08,;4,-3.86,;4.14,-5.38,;5.65,-5.7,;6.42,-4.36,;7.94,-4.2,;8.57,-2.79,;10.1,-2.63,;10.72,-1.22,;9.81,.03,;8.28,-.14,;7.66,-1.55,;5.38,-3.22,)\|
BDBM50502589	CCc1nnc(Nc2ccc(nc2)-c2ccc(cc2)[C@H]2CC[C@H](CC(O)=O)CC2)o1 \|r,wU:19.20,wD:22.24,(4.49,-29.96,;6.03,-30.12,;6.66,-31.52,;5.89,-32.86,;6.92,-34,;8.33,-33.37,;9.66,-34.14,;11,-33.37,;10.99,-31.83,;12.31,-31.06,;13.66,-31.82,;13.66,-33.36,;12.33,-34.14,;14.98,-31.05,;16.32,-31.82,;17.65,-31.04,;17.64,-29.5,;16.3,-28.74,;14.97,-29.51,;18.97,-28.73,;18.96,-27.19,;20.3,-26.42,;21.63,-27.19,;22.97,-26.42,;24.3,-27.19,;25.64,-26.42,;24.3,-28.73,;21.63,-28.73,;20.31,-29.5,;8.16,-31.84,)\|
BDBM50502588	Cc1nnc(Nc2ccc(nc2)-c2ccc(cc2)[C@H]2CC[C@H](CC(O)=O)CC2)o1 \|r,wU:18.19,wD:21.23,(5.21,-17.94,;5.84,-19.34,;5.07,-20.68,;6.1,-21.82,;7.51,-21.19,;8.85,-21.96,;10.18,-21.19,;10.17,-19.65,;11.49,-18.88,;12.84,-19.64,;12.84,-21.18,;11.51,-21.96,;14.16,-18.87,;15.5,-19.64,;16.83,-18.86,;16.83,-17.32,;15.48,-16.56,;14.16,-17.33,;18.15,-16.55,;18.14,-15.01,;19.48,-14.24,;20.82,-15.01,;22.15,-14.24,;23.49,-15.01,;24.82,-14.23,;23.49,-16.55,;20.82,-16.55,;19.49,-17.32,;7.35,-19.66,)\|
BDBM451406	CC1(C)Oc2ncnc(N)c2N=C1c1ccc(cc1)[C@H]1CC[C@H](CP(O)(=O)c2cccc(Cl)c2)CC1 \|r,wU:19.21,wD:22.25,c:12,(-2.67,-4.24,;-4,-3.47,;-2.67,-2.7,;-5.33,-4.24,;-6.67,-3.47,;-8,-4.24,;-9.34,-3.47,;-9.34,-1.93,;-8,-1.16,;-8,.38,;-6.67,-1.93,;-5.33,-1.16,;-4,-1.93,;-2.67,-1.16,;-1.33,-1.93,;,-1.16,;,.38,;-1.33,1.15,;-2.67,.38,;1.33,1.15,;1.33,2.69,;2.67,3.46,;4,2.69,;5.33,3.46,;6.67,2.7,;8,3.47,;6.67,4.24,;6.67,1.16,;5.33,.39,;5.33,-1.15,;6.67,-1.92,;8,-1.15,;9.34,-1.92,;8,.39,;4,1.15,;2.67,.38,)\|
BDBM451262	CC1(C)Oc2ncnc(N)c2N=C1c1ccc(cc1)[C@H]1CC[C@H](CP(C)(O)=O)CC1 \|r,wU:19.21,wD:22.25,c:12,(-1.44,-5.39,;-2.77,-4.62,;-1.44,-3.85,;-4.1,-5.39,;-5.44,-4.62,;-6.77,-5.39,;-8.11,-4.62,;-8.11,-3.08,;-6.77,-2.31,;-6.77,-.77,;-5.44,-3.08,;-4.1,-2.31,;-2.77,-3.08,;-1.44,-2.31,;-.1,-3.08,;1.23,-2.31,;1.23,-.77,;-.1,,;-1.44,-.77,;2.56,,;2.56,1.54,;3.9,2.31,;5.23,1.54,;6.57,2.31,;6.57,3.85,;8.11,3.85,;6.57,5.39,;5.03,3.85,;5.23,,;3.9,-.77,)\|
BDBM50502590	OC(=O)C[C@H]1CC[C@@H](CC1)c1ccc(cc1)-c1ccc(Nc2nnc(o2)C2CCC2)cn1 \|r,wU:7.10,wD:4.3,(26.75,-35.82,;25.42,-36.6,;25.42,-38.14,;24.09,-35.83,;22.75,-36.6,;21.42,-35.83,;20.08,-36.6,;20.09,-38.14,;21.43,-38.91,;22.75,-38.14,;18.76,-38.91,;18.77,-40.45,;17.44,-41.23,;16.1,-40.46,;16.09,-38.92,;17.42,-38.15,;14.77,-41.23,;13.43,-40.46,;12.1,-41.24,;12.12,-42.78,;10.78,-43.55,;9.45,-42.78,;8.04,-43.41,;7.01,-42.27,;7.77,-40.93,;9.28,-41.25,;7.15,-39.52,;7.69,-38.09,;6.25,-37.54,;5.7,-38.98,;13.44,-43.54,;14.78,-42.77,)\|
BDBM50502591	OC(=O)CC12CCC(CC1)(CO2)c1ccc(cc1)-c1ccc(Nc2nnc(o2)C2CCC2)cn1 \|(78.4,-2.43,;77.06,-3.2,;77.06,-4.74,;75.73,-2.43,;74.4,-3.2,;74.39,-4.74,;73.07,-5.51,;71.73,-4.74,;71.72,-3.2,;73.06,-2.43,;72.49,-3.4,;73.57,-4.49,;70.4,-5.51,;70.41,-7.06,;69.08,-7.83,;67.74,-7.06,;67.73,-5.53,;69.06,-4.75,;66.42,-7.84,;65.07,-7.07,;63.75,-7.84,;63.76,-9.38,;62.42,-10.15,;61.09,-9.38,;59.68,-10.02,;58.65,-8.88,;59.42,-7.54,;60.92,-7.86,;58.79,-6.14,;59.34,-4.7,;57.91,-4.15,;57.36,-5.59,;65.09,-10.15,;66.42,-9.38,)\|
BDBM451263	CP(O)(=O)[C@@H]1CCC[C@H]1C(=O)c1ccc(cc1)-c1ccc(NC(=O)Nc2ccccc2)cc1 \|r\|
BDBM451264	CC1(C)Oc2ncnc(N)c2N=C1c1ccc(cc1)[C@H]1CC[C@@H](CC1)OP(O)(O)=O \|r,wU:19.21,wD:22.28,c:12,(-2,-4.13,;-3.33,-3.36,;-2,-2.59,;-4.67,-4.13,;-6,-3.36,;-7.34,-4.13,;-8.67,-3.36,;-8.67,-1.82,;-7.34,-1.05,;-7.34,.49,;-6,-1.82,;-4.67,-1.05,;-3.33,-1.82,;-2,-1.05,;-.67,-1.82,;.67,-1.05,;.67,.49,;-.67,1.26,;-2,.49,;2,1.26,;2,2.8,;3.33,3.57,;4.67,2.8,;4.67,1.26,;3.33,.49,;6,3.57,;7.34,2.8,;8.67,3.57,;7.34,1.26,;6.57,4.13,)\|
BDBM451327	CP(O)(=O)C[C@H]1CC[C@@H](CC1)c1ccc(NC(=O)c2nnc(Nc3ccc(F)c(F)c3)o2)cc1 \|r,wU:8.11,wD:5.4,(10.71,2,;10.71,3.54,;12.04,2.77,;12.04,4.31,;9.37,4.31,;8.04,3.54,;6.7,4.31,;5.37,3.54,;5.37,2,;6.7,1.23,;8.04,2,;4.04,1.23,;4.04,-.31,;2.7,-1.08,;1.37,-.31,;.04,-1.08,;-1.3,-.31,;-1.3,1.23,;-2.63,-1.08,;-3.54,.17,;-5,-.31,;-5,-1.85,;-6.09,-2.93,;-7.58,-2.54,;-7.98,-1.05,;-9.46,-.65,;-10.55,-1.74,;-12.04,-1.34,;-10.15,-3.23,;-11.24,-4.31,;-8.67,-3.62,;-3.54,-2.32,;1.37,1.23,;2.7,2,)\|
BDBM451368	OP(O)(=O)C[C@H]1CC[C@@H](CC1)c1ccc(cc1)-n1cnc2c(Cl)ncnc12 \|r,wU:8.11,wD:5.4,(8.61,2.93,;7.07,2.93,;7.07,1.39,;7.07,4.47,;5.53,2.93,;4.2,2.16,;2.86,2.93,;1.53,2.16,;1.53,.62,;2.86,-.15,;4.2,.62,;.2,-.15,;.2,-1.69,;-1.14,-2.46,;-2.47,-1.69,;-2.47,-.15,;-1.14,.62,;-3.8,-2.46,;-3.8,-4,;-5.27,-4.47,;-6.17,-3.23,;-7.71,-3.07,;-8.61,-4.31,;-8.33,-1.66,;-7.43,-.41,;-5.9,-.57,;-5.27,-1.98,)\|
BDBM451370	CC(C)(CO)COP(O)(=O)c1ccc(NC(=O)Nc2ccccc2)cc1
BDBM451381	CC(C)COP(O)(=O)O[C@H]1CC[C@@H](CC1)c1ccc(cc1)C1=Nc2c(N)ncnc2OC1(C)C \|r,wU:12.15,wD:9.8,t:23,(9.65,5.95,;8.88,4.62,;9.65,3.29,;7.34,4.62,;6.57,3.29,;5.03,3.29,;5.03,4.83,;3.49,3.29,;5.03,1.75,;3.69,.98,;2.36,1.75,;1.02,.98,;1.02,-.56,;2.36,-1.33,;3.69,-.56,;-.31,-1.33,;-.31,-2.87,;-1.64,-3.64,;-2.98,-2.87,;-2.98,-1.33,;-1.64,-.56,;-4.31,-3.64,;-5.64,-2.87,;-6.98,-3.64,;-8.31,-2.87,;-8.31,-1.33,;-9.65,-3.64,;-9.65,-5.18,;-8.31,-5.95,;-6.98,-5.18,;-5.64,-5.95,;-4.31,-5.18,;-2.98,-5.95,;-2.98,-4.41,)\|
BDBM50502592	CCc1nc(C)c(o1)C(=O)Nc1ccc(nc1)-c1ccc(cc1)C12CCC(CC(O)=O)(CC1)OC2 \|(54.71,-38.82,;56.24,-38.66,;56.86,-37.25,;56.09,-35.92,;57.12,-34.77,;56.8,-33.27,;58.53,-35.39,;58.37,-36.93,;59.86,-34.62,;59.86,-33.08,;61.19,-35.38,;62.53,-34.61,;62.51,-33.08,;63.84,-32.3,;65.19,-33.07,;65.19,-34.61,;63.86,-35.38,;66.51,-32.29,;67.85,-33.06,;69.18,-32.29,;69.17,-30.75,;67.83,-29.98,;66.5,-30.76,;70.5,-29.97,;71.84,-30.74,;73.16,-29.97,;73.16,-28.43,;74.5,-27.66,;75.83,-28.43,;77.17,-27.66,;75.83,-29.97,;71.83,-27.66,;70.49,-28.44,;72.34,-29.72,;71.26,-28.63,)\|
BDBM451382	CCOP(O)(=O)O[C@H]1CCC(CC1)c1ccc(cc1)C1=Nc2c(N)ncnc2OC1(C)C \|r,wD:7.6,t:21,(5.23,6.54,;5.23,5,;6.57,4.23,;6.57,2.69,;8.11,2.69,;5.03,2.69,;6.57,1.15,;5.23,.38,;3.9,1.15,;2.56,.38,;2.56,-1.15,;3.9,-1.93,;5.23,-1.15,;1.23,-1.93,;1.23,-3.47,;-.1,-4.23,;-1.44,-3.47,;-1.44,-1.93,;-.1,-1.15,;-2.77,-4.23,;-4.1,-3.47,;-5.44,-4.23,;-6.77,-3.47,;-6.77,-1.93,;-8.11,-4.23,;-8.11,-5.78,;-6.77,-6.54,;-5.44,-5.78,;-4.1,-6.54,;-2.77,-5.78,;-1.44,-6.54,;-1.44,-5,)\|
BDBM451387	CC1(C)Oc2ncnc(N)c2N=C1c1ccc(cc1)C1CC[C@@H](CC1)OP(O)(=O)OC1CCCC1 \|r,wD:22.28,c:12,(-1.44,-6.51,;-2.77,-5.74,;-1.44,-4.97,;-4.1,-6.51,;-5.44,-5.74,;-6.77,-6.51,;-8.11,-5.74,;-8.11,-4.2,;-6.77,-3.43,;-6.77,-1.89,;-5.44,-4.2,;-4.1,-3.43,;-2.77,-4.2,;-1.44,-3.43,;-.1,-4.2,;1.23,-3.43,;1.23,-1.89,;-.1,-1.12,;-1.44,-1.89,;2.56,-1.12,;2.56,.42,;3.9,1.19,;5.23,.42,;5.23,-1.12,;3.9,-1.89,;6.57,1.19,;6.57,2.73,;8.11,2.73,;5.03,2.73,;6.57,4.27,;5.23,5.04,;4.76,6.51,;3.22,6.51,;2.74,5.04,;3.99,4.14,)\|
BDBM451388	CC1(C)Oc2ncnc(N)c2N=C1c1ccc(cc1)C1CC[C@@H](CC1)OP(O)(=O)Cc1ccccc1 \|r,wD:22.28,c:12,(-2.98,-6.62,;-4.31,-5.85,;-2.98,-5.08,;-5.64,-6.62,;-6.98,-5.85,;-8.31,-6.62,;-9.65,-5.85,;-9.65,-4.31,;-8.31,-3.54,;-8.31,-2,;-6.98,-4.31,;-5.64,-3.54,;-4.31,-4.31,;-2.98,-3.54,;-1.64,-4.31,;-.31,-3.54,;-.31,-2,;-1.64,-1.23,;-2.98,-2,;1.02,-1.23,;1.02,.31,;2.36,1.08,;3.69,.31,;3.69,-1.23,;2.36,-2,;5.03,1.08,;5.03,2.62,;5.03,4.16,;3.49,2.62,;6.57,2.62,;7.34,3.95,;8.88,3.95,;9.65,5.29,;8.88,6.62,;7.34,6.62,;6.57,5.29,)\|
BDBM451389	CC1(C)Oc2ncnc(N)c2N=C1c1ccc(cc1)[C@H]1CC[C@@H](CC1)OP(O)(=O)OCCc1ccccc1 \|r,wU:19.21,wD:22.28,c:12,(-4.13,-7.29,;-5.47,-6.52,;-4.13,-5.75,;-6.8,-7.29,;-8.13,-6.52,;-9.47,-7.29,;-10.8,-6.52,;-10.8,-4.98,;-9.47,-4.21,;-9.47,-2.67,;-8.13,-4.98,;-6.8,-4.21,;-5.47,-4.98,;-4.13,-4.21,;-2.8,-4.98,;-1.46,-4.21,;-1.46,-2.67,;-2.8,-1.9,;-4.13,-2.67,;-.13,-1.9,;-.13,-.36,;1.2,.41,;2.54,-.36,;2.54,-1.9,;1.2,-2.67,;3.87,.41,;3.87,1.95,;3.87,3.49,;2.33,1.95,;5.41,1.95,;6.18,3.29,;7.72,3.29,;8.49,4.62,;10.03,4.62,;10.8,5.95,;10.03,7.29,;8.49,7.29,;7.72,5.95,)\|
BDBM451390	CCP(O)(=O)O[C@H]1CC[C@@H](CC1)c1ccc(cc1)C1=Nc2c(N)ncnc2OC1(C)C \|r,wU:9.12,wD:6.5,t:20,(8.49,5.18,;7.72,3.85,;6.18,3.85,;6.18,5.39,;4.64,3.85,;6.18,2.31,;4.85,1.54,;3.51,2.31,;2.18,1.54,;2.18,,;3.51,-.77,;4.85,,;.85,-.77,;.85,-2.31,;-.49,-3.08,;-1.82,-2.31,;-1.82,-.77,;-.49,,;-3.16,-3.08,;-4.49,-2.31,;-5.82,-3.08,;-7.16,-2.31,;-7.16,-.77,;-8.49,-3.08,;-8.49,-4.62,;-7.16,-5.39,;-5.82,-4.62,;-4.49,-5.39,;-3.16,-4.62,;-1.82,-5.39,;-1.82,-3.85,)\|
BDBM451391	CC1(C)Oc2ncnc(N)c2N=C1c1ccc(cc1)[C@H]1CC[C@@H](CC1)OP(O)(=O)c1ccccc1 \|r,wU:19.21,wD:22.28,c:12,(-2.98,-5.39,;-4.31,-4.62,;-2.98,-3.85,;-5.64,-5.39,;-6.98,-4.62,;-8.31,-5.39,;-9.65,-4.62,;-9.65,-3.08,;-8.31,-2.31,;-8.31,-.77,;-6.98,-3.08,;-5.64,-2.31,;-4.31,-3.08,;-2.98,-2.31,;-1.64,-3.08,;-.31,-2.31,;-.31,-.77,;-1.64,,;-2.98,-.77,;1.02,,;1.02,1.54,;2.36,2.31,;3.69,1.54,;3.69,,;2.36,-.77,;5.03,2.31,;5.03,3.85,;5.03,5.39,;3.49,3.85,;6.57,3.85,;7.34,2.52,;8.88,2.52,;9.65,3.85,;8.88,5.18,;7.34,5.18,)\|
BDBM451392	CC1(C)Oc2ncnc(N)c2N=C1c1ccc(cc1)[C@H]1CC[C@@H](CC1)OP(O)(=O)Cc1ccc(cc1)C(O)=O \|r,wU:19.21,wD:22.28,c:12,(-3.75,-7.95,;-5.08,-7.18,;-3.75,-6.41,;-6.41,-7.95,;-7.75,-7.18,;-9.08,-7.95,;-10.42,-7.18,;-10.42,-5.64,;-9.08,-4.87,;-9.08,-3.33,;-7.75,-5.64,;-6.41,-4.87,;-5.08,-5.64,;-3.75,-4.87,;-2.41,-5.64,;-1.08,-4.87,;-1.08,-3.33,;-2.41,-2.56,;-3.75,-3.33,;.25,-2.56,;.25,-1.02,;1.59,-.25,;2.92,-1.02,;2.92,-2.56,;1.59,-3.33,;4.26,-.25,;4.26,1.29,;4.26,2.83,;2.72,1.29,;5.8,1.29,;6.57,2.62,;8.11,2.62,;8.88,3.95,;8.11,5.29,;6.57,5.29,;5.8,3.95,;8.88,6.62,;10.42,6.62,;8.11,7.95,)\|
BDBM451393	CC1(C)Oc2ncnc(N)c2N=C1c1ccc(cc1)[C@H]1CC[C@@H](CC1)OP([O-])(=O)Cc1cccc(c1)C([O-])=O \|r,wU:19.21,wD:22.28,c:12,(-2.98,-7.95,;-4.31,-7.18,;-2.98,-6.41,;-5.64,-7.95,;-6.98,-7.18,;-8.31,-7.95,;-9.65,-7.18,;-9.65,-5.64,;-8.31,-4.87,;-8.31,-3.33,;-6.98,-5.64,;-5.64,-4.87,;-4.31,-5.64,;-2.98,-4.87,;-1.64,-5.64,;-.31,-4.87,;-.31,-3.33,;-1.64,-2.56,;-2.98,-3.33,;1.02,-2.56,;1.02,-1.02,;2.36,-.25,;3.69,-1.02,;3.69,-2.56,;2.36,-3.33,;5.03,-.25,;5.03,1.29,;5.03,2.83,;3.49,1.29,;6.57,1.29,;7.34,2.62,;8.88,2.62,;9.65,3.95,;8.88,5.29,;7.34,5.29,;6.57,3.95,;6.57,6.62,;7.34,7.95,;5.03,6.62,)\|
BDBM451394	CC1(C)Oc2ncnc(N)c2N=C1c1ccc(cc1)[C@H]1CC[C@@H](CC1)OP(O)(=O)c1cccs1 \|r,wU:19.21,wD:22.28,c:12,(-2.62,-5.39,;-3.96,-4.62,;-2.62,-3.85,;-5.29,-5.39,;-6.62,-4.62,;-7.96,-5.39,;-9.29,-4.62,;-9.29,-3.08,;-7.96,-2.31,;-7.96,-.77,;-6.62,-3.08,;-5.29,-2.31,;-3.96,-3.08,;-2.62,-2.31,;-1.29,-3.08,;.05,-2.31,;.05,-.77,;-1.29,,;-2.62,-.77,;1.38,,;1.38,1.54,;2.71,2.31,;4.05,1.54,;4.05,,;2.71,-.77,;5.38,2.31,;5.38,3.85,;5.38,5.39,;3.84,3.85,;6.92,3.85,;7.83,2.6,;9.29,3.08,;9.29,4.62,;7.83,5.1,)\|
BDBM451395	CC1(C)Oc2ncnc(N)c2N=C1c1ccc(cc1)[C@H]1CC[C@@H](CC1)OP(O)(=O)c1ccsc1 \|r,wU:19.21,wD:22.28,c:12,(-2.62,-5.39,;-3.96,-4.62,;-2.62,-3.85,;-5.29,-5.39,;-6.62,-4.62,;-7.96,-5.39,;-9.29,-4.62,;-9.29,-3.08,;-7.96,-2.31,;-7.96,-.77,;-6.62,-3.08,;-5.29,-2.31,;-3.96,-3.08,;-2.62,-2.31,;-1.29,-3.08,;.05,-2.31,;.05,-.77,;-1.29,,;-2.62,-.77,;1.38,,;1.38,1.54,;2.71,2.31,;4.05,1.54,;4.05,,;2.71,-.77,;5.38,2.31,;5.38,3.85,;5.38,5.39,;3.84,3.85,;6.92,3.85,;7.83,2.6,;9.29,3.08,;9.29,4.62,;7.83,5.1,)\|
BDBM451396	CC1(C)Oc2ncnc(N)c2N=C1c1ccc(cc1)[C@H]1CC[C@H](CP(O)(=O)c2ccccc2)CC1 \|r,wU:19.21,wD:22.25,c:12,(-2,-4.24,;-3.33,-3.47,;-2,-2.7,;-4.67,-4.24,;-6,-3.47,;-7.34,-4.24,;-8.67,-3.47,;-8.67,-1.93,;-7.34,-1.16,;-7.34,.38,;-6,-1.93,;-4.67,-1.16,;-3.33,-1.93,;-2,-1.16,;-.67,-1.93,;.67,-1.16,;.67,.38,;-.67,1.16,;-2,.38,;2,1.15,;2,2.69,;3.33,3.46,;4.67,2.69,;6,3.46,;7.34,2.7,;8.67,3.47,;7.34,4.24,;7.34,1.16,;6,.39,;6,-1.15,;7.34,-1.92,;8.67,-1.15,;8.67,.39,;4.67,1.15,;3.33,.38,)\|
BDBM451397	CCP(O)(=O)C[C@H]1CC[C@@H](CC1)c1ccc(cc1)C1=Nc2c(N)ncnc2OC1(C)C \|r,wU:9.12,wD:6.5,t:20,(8.67,.39,;7.34,1.16,;7.34,2.7,;8.67,3.47,;7.34,4.24,;6,3.46,;4.67,2.69,;3.33,3.46,;2,2.69,;2,1.15,;3.33,.38,;4.67,1.15,;.67,.38,;.67,-1.16,;-.67,-1.93,;-2,-1.16,;-2,.38,;-.67,1.16,;-3.33,-1.93,;-4.67,-1.16,;-6,-1.93,;-7.34,-1.16,;-7.34,.38,;-8.67,-1.93,;-8.67,-3.47,;-7.34,-4.24,;-6,-3.47,;-4.67,-4.24,;-3.33,-3.47,;-2,-4.24,;-2,-2.7,)\|
BDBM451398	CC1(C)Oc2ncnc(N)c2N=C1c1ccc(cc1)[C@H]1CC[C@H](CP(O)(=O)C2CC2)CC1 \|r,wU:19.21,wD:22.25,c:12,(-2,-4.24,;-3.33,-3.47,;-2,-2.7,;-4.67,-4.24,;-6,-3.47,;-7.34,-4.24,;-8.67,-3.47,;-8.67,-1.93,;-7.34,-1.16,;-7.34,.38,;-6,-1.93,;-4.67,-1.16,;-3.33,-1.93,;-2,-1.16,;-.67,-1.93,;.67,-1.16,;.67,.38,;-.67,1.16,;-2,.38,;2,1.15,;2,2.69,;3.33,3.46,;4.67,2.69,;6,3.46,;7.34,2.7,;8.67,3.47,;7.34,4.24,;7.34,1.16,;6.57,-.18,;8.11,-.18,;4.67,1.15,;3.33,.38,)\|
BDBM451399	[O-]P1(=O)OCCC(O1)c1ccc(cc1)-c1ccc(NC(=O)Nc2ccccc2)cc1
BDBM451400	CC1(C)Oc2ncnc(N)c2N=C1c1ccc(cc1)[C@H]1CC[C@H](CP(O)(=O)c2cccs2)CC1 \|r,wU:19.21,wD:22.25,c:12,(-2,-4.23,;-3.33,-3.47,;-2,-2.69,;-4.67,-4.23,;-6,-3.47,;-7.34,-4.23,;-8.67,-3.47,;-8.67,-1.93,;-7.34,-1.15,;-7.34,.38,;-6,-1.93,;-4.67,-1.15,;-3.33,-1.93,;-2,-1.15,;-.67,-1.93,;.67,-1.15,;.67,.38,;-.67,1.15,;-2,.38,;2,1.15,;2,2.69,;3.33,3.47,;4.67,2.69,;6,3.47,;7.34,2.69,;8.67,3.47,;7.34,4.23,;7.34,1.15,;6.09,.25,;6.57,-1.21,;8.11,-1.21,;8.58,.25,;4.67,1.15,;3.33,.38,)\|
BDBM451401	CC1(C)Oc2ncnc(N)c2N=C1c1ccc(cc1)[C@H]1CC[C@H](CP(O)(=O)c2ccsc2)CC1 \|r,wU:19.21,wD:22.25,c:12,(-2,-4.23,;-3.33,-3.47,;-2,-2.69,;-4.67,-4.23,;-6,-3.47,;-7.34,-4.23,;-8.67,-3.47,;-8.67,-1.93,;-7.34,-1.15,;-7.34,.38,;-6,-1.93,;-4.67,-1.15,;-3.33,-1.93,;-2,-1.15,;-.67,-1.93,;.67,-1.15,;.67,.38,;-.67,1.15,;-2,.38,;2,1.15,;2,2.69,;3.33,3.47,;4.67,2.69,;6,3.47,;7.34,2.69,;8.67,3.47,;7.34,4.23,;7.34,1.15,;6.09,.25,;6.57,-1.21,;8.11,-1.21,;8.58,.25,;4.67,1.15,;3.33,.38,)\|
BDBM451402	CC1(C)Oc2ncnc(N)c2N=C1c1ccc(cc1)[C@H]1CC[C@@H](CC1)OP(O)(=O)OCc1cccnc1 \|r,wU:19.21,wD:22.28,c:12,(-4.13,-5.39,;-5.47,-4.62,;-4.13,-3.85,;-6.8,-5.39,;-8.13,-4.62,;-9.47,-5.39,;-10.8,-4.62,;-10.8,-3.08,;-9.47,-2.31,;-9.47,-.77,;-8.13,-3.08,;-6.8,-2.31,;-5.47,-3.08,;-4.13,-2.31,;-2.8,-3.08,;-1.46,-2.31,;-1.46,-.77,;-2.8,,;-4.13,-.77,;-.13,,;-.13,1.54,;1.2,2.31,;2.54,1.54,;2.54,,;1.2,-.77,;3.87,2.31,;3.87,3.85,;3.87,5.39,;2.33,3.85,;5.41,3.85,;6.18,2.52,;7.72,2.52,;8.49,1.18,;10.03,1.18,;10.8,2.52,;10.03,3.85,;8.49,3.85,)\|
BDBM451403	CC1(C)Oc2ncnc(N)c2N=C1c1ccc(cc1)[C@H]1CC[C@@H](CC1)OP(O)(=O)OCc1ccncc1 \|r,wU:19.21,wD:22.28,c:12,(-4.13,-5.39,;-5.47,-4.62,;-4.13,-3.85,;-6.8,-5.39,;-8.13,-4.62,;-9.47,-5.39,;-10.8,-4.62,;-10.8,-3.08,;-9.47,-2.31,;-9.47,-.77,;-8.13,-3.08,;-6.8,-2.31,;-5.47,-3.08,;-4.13,-2.31,;-2.8,-3.08,;-1.46,-2.31,;-1.46,-.77,;-2.8,,;-4.13,-.77,;-.13,,;-.13,1.54,;1.2,2.31,;2.54,1.54,;2.54,,;1.2,-.77,;3.87,2.31,;3.87,3.85,;3.87,5.39,;2.33,3.85,;5.41,3.85,;6.18,2.52,;7.72,2.52,;8.49,1.18,;10.03,1.18,;10.8,2.52,;10.03,3.85,;8.49,3.85,)\|
BDBM451405	CC(C)P(O)(=O)C[C@H]1CC[C@@H](CC1)c1ccc(cc1)C1=Nc2c(N)ncnc2OC1(C)C \|r,wU:10.13,wD:7.6,t:21,(8.67,.39,;7.34,1.16,;6,.39,;7.34,2.7,;8.67,3.47,;7.34,4.24,;6,3.46,;4.67,2.69,;3.33,3.46,;2,2.69,;2,1.15,;3.33,.38,;4.67,1.15,;.67,.38,;.67,-1.16,;-.67,-1.93,;-2,-1.16,;-2,.38,;-.67,1.15,;-3.33,-1.93,;-4.67,-1.16,;-6,-1.93,;-7.34,-1.16,;-7.34,.38,;-8.67,-1.93,;-8.67,-3.47,;-7.34,-4.24,;-6,-3.47,;-4.67,-4.24,;-3.33,-3.47,;-2,-4.24,;-2,-2.7,)\|
BDBM451404	CCCCP(O)(=O)C[C@H]1CC[C@@H](CC1)c1ccc(cc1)C1=Nc2c(N)ncnc2OC1(C)C \|r,wU:11.14,wD:8.7,t:22,(9.34,-1.92,;8,-1.15,;8,.39,;6.67,1.16,;6.67,2.7,;8,3.47,;6.67,4.24,;5.33,3.46,;4,2.69,;2.67,3.46,;1.33,2.69,;1.33,1.15,;2.67,.38,;4,1.15,;,.38,;,-1.16,;-1.33,-1.93,;-2.67,-1.16,;-2.67,.38,;-1.33,1.15,;-4,-1.93,;-5.33,-1.16,;-6.67,-1.93,;-8,-1.16,;-8,.38,;-9.34,-1.93,;-9.34,-3.47,;-8,-4.24,;-6.67,-3.47,;-5.33,-4.24,;-4,-3.47,;-2.67,-4.24,;-2.67,-2.7,)\|
BDBM50523591	CC1(CCCN(C1)c1ccc(cn1)-c1ccc(cn1)-c1nc2cc(Cl)ccc2[nH]1)C(O)=O
BDBM50523592	OC(=O)C[C@H]1CC[C@@H](CC1)OC1CCN(CC1)c1ccc(cn1)-c1nc2cc(F)c(F)cc2[nH]1 \|r,wU:7.10,wD:4.3,(48.64,-55.71,;47.89,-54.37,;46.35,-54.36,;48.67,-53.04,;47.91,-51.7,;48.69,-50.37,;47.93,-49.03,;46.39,-49.04,;45.61,-50.36,;46.37,-51.69,;45.63,-47.7,;44.09,-47.69,;43.31,-49.02,;41.78,-49.01,;41.02,-47.68,;41.78,-46.35,;43.32,-46.36,;39.49,-47.68,;38.71,-46.34,;37.18,-46.34,;36.41,-47.67,;37.18,-49.01,;38.72,-49.01,;34.88,-47.67,;33.97,-46.42,;32.5,-46.9,;31.16,-46.14,;29.83,-46.91,;28.5,-46.14,;29.83,-48.45,;28.5,-49.22,;31.16,-49.22,;32.5,-48.44,;33.97,-48.92,)\|
BDBM50505237	[H][C@@]12C[C@@H](C[C@]1([H])[C@H]2C(O)=O)OC1CCN(CC1)c1ccc(cn1)-c1nc2cc(ccc2[nH]1)C(F)(F)F \|r\|
BDBM50505236	[H][C@@]12C[C@H](C[C@]1([H])[C@@H]2C(O)=O)OC1CCN(CC1)c1ccc(cn1)-c1nc2cc(ccc2[nH]1)C(F)(F)F \|r\|
BDBM50505238	[H][C@@]12C[C@H](C[C@]1([H])[C@H]2C(O)=O)OC1CCN(CC1)c1ccc(cn1)-c1nc2cc(ccc2[nH]1)C(F)(F)F \|r\|
BDBM50505239	[H][C@@]12C[C@@H](C[C@]1([H])[C@@H]2C(O)=O)OC1CCN(CC1)c1ccc(cn1)-c1nc2cc(ccc2[nH]1)C(F)(F)F \|r\|
BDBM50523580	OC(=O)C[C@H]1CC[C@@H](CC1)OC1CCN(CC1)c1ccc(cn1)-c1nc2cc(ccc2[nH]1)C(F)(F)F \|r,wU:7.10,wD:4.3,(48.94,-42.6,;48.18,-41.26,;46.64,-41.25,;48.96,-39.93,;48.2,-38.59,;48.98,-37.26,;48.22,-35.92,;46.69,-35.92,;45.91,-37.24,;46.66,-38.58,;45.92,-34.59,;44.38,-34.58,;43.61,-35.91,;42.08,-35.9,;41.32,-34.57,;42.08,-33.24,;43.62,-33.25,;39.78,-34.56,;39.01,-33.23,;37.47,-33.23,;36.7,-34.56,;37.47,-35.9,;39.01,-35.9,;35.17,-34.56,;34.26,-33.31,;32.79,-33.78,;31.46,-33.02,;30.13,-33.79,;30.13,-35.34,;31.46,-36.11,;32.79,-35.33,;34.26,-35.81,;28.79,-33.02,;28.79,-31.48,;27.46,-33.79,;27.45,-32.25,)\|
BDBM50523581	Cc1ccc2[nH]c(nc2n1)-c1ccc(nc1)N1CCC(CC1)O[C@H]1CC[C@H](CC(O)=O)CC1 \|r,wU:23.26,wD:26.30,(57.02,-18.4,;58.35,-19.17,;58.35,-20.72,;59.68,-21.49,;61.02,-20.71,;62.49,-21.19,;63.4,-19.94,;62.49,-18.69,;61.02,-19.16,;59.68,-18.4,;64.93,-19.94,;65.7,-18.61,;67.23,-18.6,;68.01,-19.94,;67.23,-21.28,;65.7,-21.27,;69.54,-19.94,;70.3,-21.28,;71.83,-21.28,;72.61,-19.96,;71.84,-18.62,;70.3,-18.61,;74.15,-19.96,;74.91,-21.3,;76.45,-21.29,;77.21,-22.64,;76.43,-23.97,;77.19,-25.31,;76.4,-26.64,;77.16,-27.98,;74.86,-26.62,;74.89,-23.95,;74.13,-22.62,)\|
BDBM50523582	CN1CCN(CC1)c1ccc(cn1)-c1ccc(cc1)-c1nc2cc(ccc2[nH]1)C(F)(F)F
BDBM50523583	CC(C)(COc1ccc(cn1)-c1ccc(cn1)-c1nc2cc(Cl)ccc2[nH]1)C(O)=O
BDBM50523584	OC(=O)C[C@H]1CC[C@H](CC1)Oc1ccc(cn1)-c1ccc(cn1)-c1nc2cc(ccc2[nH]1)C(F)(F)F \|r,wD:7.10,4.3,(24.82,-57.8,;24.05,-56.46,;22.51,-56.46,;24.82,-55.13,;24.05,-53.8,;24.83,-52.46,;24.06,-51.12,;22.52,-51.14,;21.75,-52.46,;22.51,-53.79,;21.75,-49.8,;20.21,-49.81,;19.43,-48.47,;17.9,-48.47,;17.13,-49.8,;17.9,-51.14,;19.44,-51.14,;15.6,-49.8,;14.82,-48.46,;13.28,-48.47,;12.52,-49.8,;13.28,-51.13,;14.82,-51.14,;10.98,-49.8,;10.08,-48.55,;8.6,-49.02,;7.27,-48.26,;5.94,-49.03,;5.94,-50.58,;7.27,-51.35,;8.6,-50.57,;10.07,-51.05,;4.61,-48.26,;4.61,-46.72,;3.27,-49.03,;3.27,-47.49,)\|
BDBM50523585	OC(=O)c1ccc(CNc2ccc(cn2)-c2ccc(cn2)-c2nc3cc(Cl)ccc3[nH]2)cc1
BDBM50523587	OC(=O)C1(COc2ccc(cn2)-c2ccc(cn2)-c2nc3cc(Cl)ccc3[nH]2)CCC1
BDBM50523588	OC(=O)C[C@H]1CC[C@H](CC1)Oc1ccc(cn1)-c1ccc(cn1)-c1nc2cc(F)ccc2[nH]1 \|r,wD:7.10,4.3,(24,-13.44,;23.23,-12.11,;21.69,-12.1,;24,-10.77,;23.24,-9.44,;24.01,-8.1,;23.24,-6.76,;21.71,-6.78,;20.93,-8.11,;21.7,-9.43,;20.93,-5.45,;19.39,-5.45,;18.62,-4.11,;17.08,-4.12,;16.31,-5.45,;17.08,-6.78,;18.62,-6.78,;14.78,-5.45,;14,-4.11,;12.47,-4.11,;11.7,-5.44,;12.47,-6.78,;14.01,-6.78,;10.17,-5.44,;9.26,-4.19,;7.79,-4.67,;6.45,-3.9,;5.12,-4.67,;3.79,-3.9,;5.12,-6.22,;6.45,-6.99,;7.79,-6.21,;9.26,-6.69,)\|
BDBM50523590	FC(F)(F)c1ccc2[nH]c(nc2c1)-c1ccc(cc1)-c1ccc(nc1)C#N
BDBM50523593	FC(F)(F)c1ccc2[nH]c(nc2c1)-c1ccc(cc1)-c1ccc(nc1)N1CCOCC1
BDBM50523594	OC(=O)C[C@H]1CC[C@H](CC1)Oc1ccc(cn1)-c1ccc(cn1)-c1nc2cc(Cl)ccc2[nH]1 \|r,wD:7.10,4.3,(78.66,-47.58,;77.89,-46.25,;76.35,-46.24,;78.67,-44.91,;77.9,-43.58,;78.67,-42.25,;77.9,-40.91,;76.37,-40.92,;75.59,-42.25,;76.36,-43.57,;75.6,-39.59,;74.06,-39.59,;73.28,-38.25,;71.74,-38.26,;70.98,-39.59,;71.75,-40.92,;73.29,-40.92,;69.44,-39.59,;68.67,-38.25,;67.13,-38.25,;66.36,-39.58,;67.13,-40.92,;68.67,-40.92,;64.83,-39.58,;63.92,-38.33,;62.45,-38.81,;61.12,-38.04,;59.79,-38.82,;58.45,-38.05,;59.78,-40.36,;61.12,-41.13,;62.45,-40.35,;63.92,-40.83,)\|
BDBM50523595	COc1ccc2[nH]c(nc2n1)-c1ccc(nc1)-c1ccc(O[C@@H]2CC[C@H](CC(O)=O)CC2)nc1 \|r,wD:22.24,25.28,(51.11,-19.76,;52.44,-18.99,;53.78,-19.76,;53.78,-21.31,;55.11,-22.08,;56.44,-21.3,;57.91,-21.78,;58.82,-20.53,;57.91,-19.28,;56.44,-19.75,;55.11,-18.99,;60.35,-20.53,;61.12,-19.2,;62.66,-19.19,;63.43,-20.53,;62.66,-21.87,;61.12,-21.86,;64.97,-20.53,;65.73,-19.2,;67.27,-19.2,;68.05,-20.54,;69.59,-20.53,;70.36,-21.87,;71.89,-21.85,;72.66,-23.19,;71.89,-24.53,;72.66,-25.86,;71.88,-27.19,;72.65,-28.53,;70.34,-27.19,;70.35,-24.52,;69.58,-23.19,;67.28,-21.87,;65.74,-21.87,)\|
BDBM50523596	OC(=O)C[C@H]1CC[C@@H](CC1)OC1CCN(CC1)c1ccc(cn1)-c1nc2cc(Cl)ccc2[nH]1 \|r,wU:7.10,wD:4.3,(73.88,-44.52,;73.12,-43.18,;71.58,-43.17,;73.9,-41.85,;73.14,-40.51,;73.92,-39.18,;73.16,-37.84,;71.63,-37.85,;70.84,-39.17,;71.6,-40.5,;70.86,-36.51,;69.32,-36.5,;68.55,-37.83,;67.02,-37.82,;66.26,-36.49,;67.02,-35.16,;68.56,-35.17,;64.72,-36.49,;63.94,-35.15,;62.41,-35.15,;61.64,-36.48,;62.41,-37.82,;63.95,-37.82,;60.11,-36.48,;59.2,-35.23,;57.73,-35.71,;56.39,-34.95,;55.07,-35.72,;53.73,-34.95,;55.06,-37.26,;56.4,-38.03,;57.73,-37.25,;59.2,-37.73,)\|
BDBM50523598	OC(=O)C[C@H]1CC[C@H](CC1)Oc1ccc(cn1)-c1ccc(cn1)-c1nc2cc(cnc2[nH]1)C(F)(F)F \|r,wD:7.10,4.3,(46.61,-28,;45.84,-26.67,;44.3,-26.66,;46.62,-25.34,;45.85,-24,;46.62,-22.67,;45.85,-21.33,;44.32,-21.34,;43.54,-22.67,;44.31,-23.99,;43.55,-20.01,;42.01,-20.01,;41.23,-18.67,;39.69,-18.68,;38.93,-20.01,;39.7,-21.34,;41.23,-21.34,;37.39,-20.01,;36.61,-18.67,;35.08,-18.67,;34.31,-20,;35.08,-21.34,;36.62,-21.34,;32.78,-20,;31.87,-18.75,;30.4,-19.23,;29.06,-18.46,;27.73,-19.23,;27.73,-20.78,;29.07,-21.55,;30.4,-20.77,;31.87,-21.25,;26.4,-18.47,;26.4,-16.93,;25.07,-19.24,;25.06,-17.69,)\|
BDBM50523599	Cc1ccc2[nH]c(nc2n1)-c1ccc(nc1)-c1ccc(O[C@@H]2CC[C@H](CC(O)=O)CC2)nc1 \|r,wD:21.23,24.27,(4.56,-32.27,;5.89,-33.04,;5.89,-34.59,;7.22,-35.36,;8.56,-34.58,;10.03,-35.06,;10.94,-33.81,;10.03,-32.56,;8.56,-33.04,;7.22,-32.27,;12.47,-33.81,;13.23,-32.48,;14.77,-32.48,;15.55,-33.81,;14.77,-35.15,;13.24,-35.15,;17.08,-33.82,;17.85,-32.49,;19.38,-32.48,;20.16,-33.82,;21.7,-33.82,;22.47,-35.15,;24.01,-35.13,;24.78,-36.47,;24,-37.81,;24.77,-39.14,;24,-40.48,;24.77,-41.81,;22.46,-40.47,;22.46,-37.8,;21.7,-36.47,;19.39,-35.15,;17.85,-35.15,)\|
BDBM50523600	OC(=O)C[C@H]1CC[C@@H](CC1)OC1CCN(CC1)c1ccc(cn1)-c1nc2c(F)cc(F)cc2[nH]1 \|r,wU:7.10,wD:4.3,(22.62,-56.01,;21.86,-54.67,;20.32,-54.66,;22.64,-53.34,;21.88,-52,;22.66,-50.67,;21.9,-49.33,;20.37,-49.33,;19.59,-50.65,;20.34,-51.99,;19.61,-48,;18.07,-47.99,;17.29,-49.32,;15.76,-49.31,;15,-47.98,;15.76,-46.65,;17.3,-46.65,;13.46,-47.97,;12.69,-46.64,;11.15,-46.64,;10.39,-47.97,;11.15,-49.31,;12.69,-49.31,;8.85,-47.97,;7.94,-46.72,;6.47,-47.19,;5.14,-46.43,;5.13,-44.89,;3.81,-47.2,;3.81,-48.75,;2.47,-49.52,;5.14,-49.52,;6.47,-48.74,;7.94,-49.22,)\|
BDBM50523601	OC(=O)c1ccc(Oc2ccc(cn2)-c2ccc(cn2)-c2nc3cc(Cl)ccc3[nH]2)cc1
BDBM50523602	OC(=O)C1CC(C1)Oc1ccc(cn1)-c1ccc(cn1)-c1nc2cc(Cl)ccc2[nH]1 \|(75.16,-35.1,;75.92,-33.76,;77.46,-33.75,;75.14,-32.44,;73.65,-32.05,;74.03,-30.56,;75.52,-30.95,;73.25,-29.23,;71.71,-29.25,;70.92,-27.92,;69.38,-27.94,;68.62,-29.27,;69.41,-30.6,;70.95,-30.59,;67.09,-29.29,;66.31,-27.95,;64.77,-27.97,;64.01,-29.3,;64.79,-30.63,;66.33,-30.62,;62.47,-29.31,;61.56,-28.07,;60.09,-28.55,;58.75,-27.79,;57.42,-28.56,;56.09,-27.79,;57.42,-30.1,;58.76,-30.88,;60.1,-30.1,;61.57,-30.56,)\|
BDBM50523603	OC(=O)C1CC1COc1ccc(cn1)-c1ccc(cn1)-c1nc2cc(Cl)ccc2[nH]1
BDBM50523604	OC(=O)C[C@H]1CC[C@H](CC1)Oc1ccc(cn1)-c1ccc(cn1)-c1nc2c(F)cc(F)cc2[nH]1 \|r,wD:7.10,4.3,(77.9,-58.59,;77.14,-57.26,;75.6,-57.25,;77.91,-55.92,;77.14,-54.59,;77.91,-53.25,;77.15,-51.91,;75.61,-51.93,;74.84,-53.25,;75.6,-54.58,;74.84,-50.59,;73.3,-50.6,;72.52,-49.26,;70.99,-49.27,;70.22,-50.59,;70.99,-51.93,;72.53,-51.93,;68.68,-50.59,;67.91,-49.25,;66.37,-49.26,;65.61,-50.59,;66.37,-51.93,;67.91,-51.93,;64.07,-50.59,;63.16,-49.34,;61.69,-49.81,;60.36,-49.05,;60.35,-47.51,;59.03,-49.82,;59.03,-51.37,;57.69,-52.14,;60.36,-52.14,;61.69,-51.36,;63.16,-51.84,)\|
BDBM50523605	OC(=O)C[C@H]1CC[C@H](CC1)Oc1ccc(cn1)-c1ccc(cn1)-c1nc2ccccc2[nH]1 \|r,wD:7.10,4.3,(24.54,-28.12,;23.77,-26.78,;22.23,-26.78,;24.54,-25.45,;23.77,-24.12,;24.55,-22.78,;23.78,-21.44,;22.24,-21.46,;21.47,-22.78,;22.23,-24.11,;21.47,-20.12,;19.93,-20.13,;19.15,-18.79,;17.62,-18.79,;16.85,-20.12,;17.62,-21.46,;19.16,-21.46,;15.32,-20.12,;14.54,-18.78,;13,-18.79,;12.24,-20.12,;13,-21.45,;14.54,-21.46,;10.7,-20.12,;9.8,-18.87,;8.32,-19.34,;6.99,-18.58,;5.66,-19.35,;5.66,-20.9,;6.99,-21.67,;8.32,-20.89,;9.79,-21.37,)\|
BDBM50523606	OC(=O)C[C@H]1CC[C@@H](CC1)OC1CCN(CC1)c1ccc(cn1)-c1nc2c(F)cccc2[nH]1 \|r,wU:7.10,wD:4.3,(75.44,-57.01,;74.68,-55.67,;73.14,-55.65,;75.46,-54.34,;74.71,-53,;75.49,-51.67,;74.72,-50.32,;73.19,-50.33,;72.41,-51.65,;73.16,-52.98,;72.43,-48.99,;70.89,-48.99,;70.11,-50.31,;68.58,-50.31,;67.82,-48.97,;68.58,-47.64,;70.12,-47.65,;66.29,-48.97,;65.51,-47.63,;63.97,-47.64,;63.21,-48.97,;63.97,-50.3,;65.51,-50.3,;61.67,-48.97,;60.77,-47.72,;59.29,-48.19,;57.96,-47.43,;57.95,-45.89,;56.63,-48.2,;56.63,-49.74,;57.96,-50.52,;59.29,-49.74,;60.76,-50.22,)\|
BDBM50523607	OC(=O)C[C@H]1CC[C@@H](CC1)OC1CCN(CC1)c1ccc(cn1)-c1nc2cc(cnc2[nH]1)C(F)(F)F \|r,wU:7.10,wD:4.3,(48.73,-14.68,;47.97,-13.34,;46.43,-13.32,;48.76,-12.01,;48,-10.67,;48.78,-9.34,;48.02,-8,;46.48,-8,;45.7,-9.32,;46.46,-10.66,;45.72,-6.67,;44.18,-6.66,;43.4,-7.98,;41.87,-7.98,;41.11,-6.64,;41.87,-5.32,;43.41,-5.32,;39.58,-6.64,;38.8,-5.3,;37.26,-5.31,;36.5,-6.64,;37.26,-7.97,;38.8,-7.98,;34.96,-6.64,;34.06,-5.39,;32.59,-5.86,;31.25,-5.1,;29.92,-5.87,;29.92,-7.42,;31.25,-8.19,;32.58,-7.41,;34.05,-7.89,;28.59,-5.1,;28.59,-3.56,;27.25,-5.87,;27.25,-4.33,)\|
BDBM50523608	OC(=O)C[C@H]1CC[C@@H](CC1)OC1CCN(CC1)c1ccc(cn1)-c1nc2cc(Cl)cnc2[nH]1 \|r,wU:7.10,wD:4.3,(49.43,-27.28,;48.68,-25.94,;47.14,-25.93,;49.46,-24.61,;48.7,-23.27,;49.48,-21.94,;48.72,-20.6,;47.18,-20.6,;46.4,-21.92,;47.16,-23.26,;46.42,-19.27,;44.88,-19.26,;44.1,-20.59,;42.57,-20.58,;41.81,-19.25,;42.57,-17.92,;44.11,-17.92,;40.28,-19.24,;39.5,-17.91,;37.96,-17.91,;37.2,-19.24,;37.97,-20.58,;39.5,-20.58,;35.66,-19.24,;34.76,-17.99,;33.29,-18.46,;31.95,-17.7,;30.62,-18.47,;29.29,-17.7,;30.62,-20.02,;31.95,-20.79,;33.28,-20.01,;34.75,-20.49,)\|
BDBM50523609	OC(=O)C[C@H]1CC[C@@H](CC1)c1ccc(cc1)-c1ccc(cc1)-c1nc2cc(Cl)ccc2[nH]1 \|r,wU:7.10,wD:4.3,(54.96,-34.16,;53.42,-34.16,;52.65,-35.49,;52.65,-32.82,;51.11,-32.82,;50.34,-31.49,;48.8,-31.48,;48.03,-32.82,;48.8,-34.15,;50.34,-34.15,;46.5,-32.82,;45.73,-34.15,;44.19,-34.15,;43.42,-32.82,;44.18,-31.49,;45.72,-31.48,;41.88,-32.81,;41.11,-34.15,;39.57,-34.15,;38.8,-32.81,;39.57,-31.48,;41.11,-31.48,;37.27,-32.81,;36.36,-31.56,;34.89,-32.03,;33.56,-31.27,;32.23,-32.04,;30.89,-31.27,;32.23,-33.59,;33.56,-34.36,;34.89,-33.58,;36.36,-34.06,)\|
BDBM50523610	FC(F)(F)c1ccc2[nH]c(nc2c1)-c1ccc(cc1)-c1ccc(cc1)C#N
BDBM50523611	CN1CCN(CC1)c1ccc(cc1)-c1ccc(cc1)-c1nc2cc(ccc2[nH]1)C(F)(F)F
BDBM50523612	CC1(CCN(CC1)c1ccc(cn1)-c1ccc(cn1)-c1nc2cc(Cl)ccc2[nH]1)C(O)=O
BDBM50523613	OC(=O)C1(CNc2ccc(cn2)-c2ccc(cn2)-c2nc3cc(Cl)ccc3[nH]2)CC1
BDBM50523614	CC1(C)CN(CCC1CC(O)=O)c1ccc(cn1)-c1ccc(cn1)-c1nc2cc(Cl)ccc2[nH]1
BDBM50523615	OC(=O)C1CCC(CC1)Nc1ccc(cn1)-c1ccc(cn1)-c1nc2cc(Cl)ccc2[nH]1 \|(53.38,-45.19,;51.84,-45.2,;51.06,-43.87,;51.08,-46.54,;51.85,-47.87,;51.09,-49.2,;49.56,-49.2,;48.77,-47.89,;49.54,-46.55,;48.8,-50.54,;47.26,-50.56,;46.47,-49.23,;44.94,-49.24,;44.18,-50.58,;44.96,-51.91,;46.5,-51.9,;42.65,-50.59,;41.87,-49.26,;40.33,-49.27,;39.57,-50.61,;40.35,-51.94,;41.89,-51.93,;38.04,-50.62,;37.12,-49.37,;35.66,-49.86,;34.32,-49.1,;32.99,-49.87,;31.66,-49.1,;32.99,-51.41,;34.33,-52.18,;35.67,-51.4,;37.14,-51.87,)\|
BDBM50523616	OC(=O)C1CC(C1)Nc1ccc(cn1)-c1ccc(cn1)-c1nc2cc(Cl)ccc2[nH]1 \|(52.65,-10.72,;53.41,-9.38,;54.95,-9.36,;52.63,-8.05,;51.14,-7.66,;51.53,-6.17,;53.02,-6.56,;50.75,-4.85,;49.21,-4.86,;48.42,-3.53,;46.89,-3.55,;46.13,-4.88,;46.91,-6.21,;48.45,-6.2,;44.6,-4.89,;43.81,-3.56,;42.28,-3.58,;41.52,-4.91,;42.3,-6.24,;43.84,-6.23,;39.98,-4.92,;39.07,-3.68,;37.61,-4.16,;36.27,-3.4,;34.94,-4.17,;33.61,-3.4,;34.94,-5.71,;36.27,-6.48,;37.61,-5.7,;39.08,-6.17,)\|
BDBM50523617	OC(=O)C1(COc2ccc(cn2)-c2ccc(cn2)-c2nc3cc(Cl)ccc3[nH]2)CC1
BDBM50523618	OC(=O)C1(COc2ccc(cn2)-c2ccc(cn2)-c2nc3cc(Cl)ccc3[nH]2)COC1
BDBM50523619	OC(=O)C[C@H]1CC[C@H](CC1)Oc1ccc(cn1)-c1ccc(cn1)-c1nc2cc(Cl)cnc2[nH]1 \|r,wD:7.10,4.3,(47.07,-14.03,;46.31,-12.69,;44.77,-12.69,;47.08,-11.36,;46.31,-10.02,;47.08,-8.69,;46.32,-7.35,;44.78,-7.36,;44.01,-8.69,;44.77,-10.02,;44.01,-6.03,;42.47,-6.03,;41.69,-4.69,;40.16,-4.7,;39.39,-6.03,;40.16,-7.37,;41.7,-7.37,;37.85,-6.03,;37.08,-4.69,;35.54,-4.69,;34.78,-6.02,;35.54,-7.36,;37.08,-7.36,;33.24,-6.02,;32.33,-4.77,;30.86,-5.25,;29.53,-4.49,;28.2,-5.26,;26.87,-4.49,;28.2,-6.8,;29.53,-7.57,;30.86,-6.8,;32.33,-7.27,)\|
BDBM50523620	OC(=O)C[C@H]1CC[C@@H](CC1)OC1CCN(CC1)c1ccc(cn1)-c1nc2cc(ccc2[nH]1)C#N \|r,wU:7.10,wD:4.3,(72.91,-13.35,;72.15,-12.01,;70.61,-11.99,;72.93,-10.68,;72.17,-9.34,;72.95,-8.01,;72.19,-6.67,;70.65,-6.67,;69.87,-7.99,;70.63,-9.33,;69.89,-5.34,;68.35,-5.33,;67.57,-6.65,;66.04,-6.65,;65.29,-5.31,;66.04,-3.99,;67.59,-3.99,;63.75,-5.31,;62.97,-3.97,;61.44,-3.98,;60.67,-5.31,;61.44,-6.64,;62.98,-6.65,;59.14,-5.31,;58.23,-4.06,;56.76,-4.53,;55.42,-3.77,;54.09,-4.54,;54.09,-6.09,;55.43,-6.86,;56.76,-6.08,;58.23,-6.56,;52.76,-3.77,;51.43,-3,)\|
BDBM50523621	FC(F)(F)c1ccc2[nH]c(nc2c1)-c1ccc(cc1)-c1ccccc1
BDBM50523622	FC(F)(F)c1ccc2[nH]c(nc2c1)-c1ccc(cc1)-c1cccnc1
BDBM50523623	Oc1ccc(cn1)-c1ccc(cc1)-c1nc2cc(ccc2[nH]1)C(F)(F)F
BDBM50523624	Oc1ccc(cc1)-c1ccc(cc1)-c1nc2cc(ccc2[nH]1)C(F)(F)F
BDBM50523625	OC(=O)C1CCCCC1Nc1ccc(cn1)-c1ccc(cn1)-c1nc2cc(Cl)ccc2[nH]1
BDBM50523626	OC(=O)CC1CCN(CC1)c1ccc(cn1)-c1ccc(cn1)-c1nc2cc(Cl)ccc2[nH]1
BDBM50523627	OC(=O)C[C@H]1CC[C@@H](CC1)OC1CCN(CC1)c1ccc(cn1)-c1nc2ccccc2[nH]1 \|r,wU:7.10,wD:4.3,(22.74,-13.34,;21.99,-12,;20.45,-11.99,;22.77,-10.67,;22.01,-9.33,;22.79,-8,;22.03,-6.66,;20.49,-6.66,;19.71,-7.98,;20.47,-9.32,;19.73,-5.33,;18.19,-5.32,;17.41,-6.65,;15.88,-6.64,;15.13,-5.31,;15.88,-3.98,;17.42,-3.99,;13.59,-5.31,;12.81,-3.97,;11.28,-3.97,;10.51,-5.3,;11.28,-6.64,;12.82,-6.64,;8.98,-5.3,;8.07,-4.05,;6.6,-4.53,;5.26,-3.76,;3.93,-4.53,;3.93,-6.08,;5.26,-6.85,;6.6,-6.07,;8.07,-6.55,)\|
BDBM50523628	OC(=O)C[C@H]1CC[C@@H](CC1)c1ccc(cc1)-c1ccc(cc1)-c1nc2cc(ccc2[nH]1)C(F)(F)F \|r,wU:7.10,wD:4.3,(26.97,-32.86,;25.43,-32.86,;24.65,-34.19,;24.66,-31.53,;23.12,-31.52,;22.35,-30.19,;20.81,-30.18,;20.04,-31.52,;20.81,-32.85,;22.35,-32.85,;18.51,-31.52,;17.74,-32.85,;16.2,-32.85,;15.43,-31.52,;16.19,-30.19,;17.73,-30.18,;13.89,-31.52,;13.12,-32.85,;11.58,-32.85,;10.81,-31.51,;11.58,-30.18,;13.12,-30.18,;9.28,-31.51,;8.37,-30.26,;6.9,-30.74,;5.56,-29.97,;4.24,-30.74,;4.23,-32.29,;5.57,-33.06,;6.9,-32.28,;8.37,-32.76,;2.9,-29.97,;2.9,-28.43,;1.57,-30.75,;1.56,-29.2,)\|
BDBM50523586	OC(=O)C[C@H]1CC[C@H](CC1)Oc1ccc(cn1)-c1ccc(cn1)-c1nc2cc(F)c(F)cc2[nH]1 \|r,wD:7.10,4.3,(51.56,-57.92,;50.79,-56.58,;49.25,-56.58,;51.56,-55.25,;50.79,-53.91,;51.57,-52.58,;50.8,-51.24,;49.26,-51.25,;48.49,-52.58,;49.25,-53.91,;48.49,-49.92,;46.95,-49.92,;46.17,-48.58,;44.64,-48.59,;43.87,-49.92,;44.64,-51.26,;46.18,-51.26,;42.34,-49.92,;41.56,-48.58,;40.02,-48.59,;39.26,-49.91,;40.03,-51.25,;41.56,-51.25,;37.72,-49.92,;36.82,-48.66,;35.35,-49.14,;34.01,-48.38,;32.68,-49.15,;31.35,-48.38,;32.68,-50.69,;31.34,-51.46,;34.01,-51.46,;35.34,-50.69,;36.81,-51.17,)\|
BDBM50523597	OC(=O)C[C@H]1CC[C@H](CC1)Oc1ccc(cn1)-c1ccc(cn1)-c1nc2cc(ccc2[nH]1)C#N \|r,wD:7.10,4.3,(71.52,-14.35,;70.76,-13.02,;69.22,-13.01,;71.53,-11.69,;70.76,-10.35,;71.53,-9.02,;70.76,-7.67,;69.23,-7.69,;68.45,-9.02,;69.22,-10.34,;68.46,-6.36,;66.92,-6.36,;66.14,-5.02,;64.6,-5.03,;63.84,-6.36,;64.61,-7.69,;66.15,-7.69,;62.3,-6.36,;61.53,-5.02,;59.99,-5.02,;59.22,-6.35,;59.99,-7.69,;61.53,-7.69,;57.69,-6.35,;56.78,-5.1,;55.31,-5.58,;53.98,-4.81,;52.65,-5.58,;52.64,-7.13,;53.98,-7.9,;55.31,-7.12,;56.78,-7.6,;51.32,-4.81,;49.98,-4.04,)\|
BDBM50502585	OC(=O)CC12CCC(CC1)(CO2)c1ccc(cc1)-c1ccc(Nc2nnc(o2)C2CCC2)cc1 \|(78.38,-14.6,;77.05,-15.37,;77.05,-16.91,;75.72,-14.6,;74.38,-15.37,;74.38,-16.91,;73.06,-17.68,;71.72,-16.91,;71.71,-15.38,;73.05,-14.6,;72.47,-15.57,;73.56,-16.66,;70.39,-17.69,;70.4,-19.23,;69.07,-20,;67.73,-19.23,;67.72,-17.7,;69.05,-16.92,;66.4,-20.01,;66.41,-21.55,;65.07,-22.32,;63.75,-21.55,;62.41,-22.32,;61.08,-21.56,;59.67,-22.19,;58.64,-21.05,;59.41,-19.71,;60.91,-20.03,;58.78,-18.31,;59.33,-16.87,;57.9,-16.32,;57.35,-17.76,;63.73,-20.02,;65.06,-19.24,)\|
BDBM50502586	OC(=O)C[C@H]1CC[C@@H](CC1)c1ccc(cc1)-c1ccc(Nc2ccc(nc2)C(F)(F)F)cn1 \|r,wU:4.3,wD:7.10,(-2.34,-12.23,;-2.34,-10.69,;-3.68,-9.92,;-1.01,-9.92,;-1.01,-8.38,;-2.34,-7.61,;-2.34,-6.07,;-1.01,-5.3,;.32,-6.07,;.32,-7.61,;-1.01,-3.76,;-2.34,-2.99,;-2.34,-1.45,;-1.01,-.68,;.32,-1.45,;.32,-2.99,;-1.01,.86,;-2.34,1.63,;-2.34,3.17,;-1.01,3.94,;-1.01,5.48,;.32,6.25,;.32,7.79,;1.66,8.56,;2.99,7.79,;2.99,6.25,;1.66,5.48,;4.32,8.56,;5.66,9.33,;5.09,7.23,;3.55,9.9,;.32,3.17,;.32,1.63,)\|
BDBM50502587	CCc1nc(C)c(o1)C(=O)Nc1ccc(cc1)-c1ccc(cc1)C12CCC(CC(O)=O)(CC1)OC2 \|(4.98,-14.22,;6.51,-14.06,;7.13,-12.65,;6.36,-11.32,;7.39,-10.17,;7.06,-8.66,;8.79,-10.79,;8.64,-12.33,;10.13,-10.01,;10.12,-8.47,;11.46,-10.78,;12.79,-10.01,;14.12,-10.78,;15.45,-10.01,;15.45,-8.47,;14.11,-7.7,;12.78,-8.47,;16.78,-7.69,;18.11,-8.46,;19.44,-7.69,;19.44,-6.14,;18.1,-5.38,;16.77,-6.16,;20.77,-5.37,;22.1,-6.14,;23.43,-5.37,;23.43,-3.83,;24.77,-3.06,;26.1,-3.83,;27.43,-3.06,;26.1,-5.37,;22.1,-3.06,;20.76,-3.83,;22.61,-5.12,;21.52,-4.03,)\|
BDBM50502593	CCc1nc(C)c(o1)C(=O)Nc1ccc(nc1)-c1ccc(cc1)[C@H]1CC[C@H](CC(O)=O)CC1 \|r,wU:23.25,wD:26.29,(29.78,-24.78,;31.31,-24.62,;31.93,-23.21,;31.16,-21.88,;32.19,-20.73,;31.87,-19.23,;33.6,-21.35,;33.44,-22.89,;34.93,-20.58,;34.93,-19.04,;36.26,-21.34,;37.6,-20.57,;37.59,-19.04,;38.91,-18.26,;40.26,-19.03,;40.26,-20.57,;38.93,-21.34,;41.58,-18.25,;42.92,-19.02,;44.25,-18.25,;44.24,-16.71,;42.9,-15.94,;41.57,-16.72,;45.57,-15.93,;45.56,-14.4,;46.9,-13.62,;48.23,-14.39,;49.57,-13.62,;50.9,-14.39,;52.24,-13.62,;50.9,-15.93,;48.23,-15.93,;46.91,-16.7,)\|
BDBM50502594	CC(C)c1nnc(Nc2ccc(nc2)-c2ccc(cc2)N2CCC(CC(O)=O)CC2)o1
BDBM50502595	OC(=O)C[C@H]1CC[C@@H](CC1)c1ccc(cc1)-c1ccc(Nc2nnc(s2)C2CCC2)cn1 \|r,wU:7.10,wD:4.3,(51.91,-2.96,;50.57,-3.73,;50.58,-5.27,;49.24,-2.97,;47.91,-3.74,;46.57,-2.97,;45.23,-3.74,;45.24,-5.28,;46.58,-6.05,;47.91,-5.28,;43.92,-6.05,;43.92,-7.59,;42.59,-8.37,;41.25,-7.6,;41.25,-6.06,;42.57,-5.29,;39.93,-8.37,;38.58,-7.6,;37.26,-8.38,;37.27,-9.92,;35.94,-10.69,;34.6,-9.92,;33.19,-10.55,;32.16,-9.41,;32.93,-8.07,;34.44,-8.39,;32.3,-6.66,;32.85,-5.23,;31.41,-4.68,;30.86,-6.12,;38.6,-10.68,;39.93,-9.91,)\|
BDBM50523589	COc1ccc2[nH]c(nc2n1)-c1ccc(nc1)N1CCC(CC1)O[C@H]1CC[C@H](CC(O)=O)CC1 \|r,wU:24.27,wD:27.31,(2.14,-18.07,;3.48,-17.3,;4.81,-18.07,;4.81,-19.61,;6.14,-20.38,;7.48,-19.61,;8.95,-20.09,;9.86,-18.84,;8.95,-17.58,;7.48,-18.06,;6.14,-17.3,;11.39,-18.83,;12.16,-17.5,;13.69,-17.5,;14.47,-18.84,;13.7,-20.17,;12.16,-20.17,;16,-18.84,;16.76,-20.18,;18.29,-20.18,;19.07,-18.85,;18.3,-17.52,;16.76,-17.51,;20.61,-18.86,;21.37,-20.2,;22.91,-20.19,;23.67,-21.54,;22.89,-22.87,;23.65,-24.21,;22.87,-25.53,;23.62,-26.87,;21.33,-25.52,;21.35,-22.85,;20.59,-21.52,)\|
BDBM50230541	[#6]\[#6](-[#6])=[#6]\[#6]-c1c2-[#8]\[#6](=[#6]/c3ccc(-[#8])cc3)-[#6](=O)-c2ccc1-[#8]
BDBM50579519	Cc1ccc(cc1)C1=C(c2nn[nH]n2)C(O)=N[C@@](C1)(c1ccc(OCCCC(F)(F)F)cc1)C(F)(F)F \|r,c:8,17\|
BDBM50579526	Cc1ccc(cc1)C1=C(c2nnn[nH]2)C(=O)N[C@@](C1)(c1ccc(OCCCCCC(F)(F)F)cc1)C(F)(F)F \|r,c:8\|
BDBM50599924	OC(=O)CC1CCC2(CC1)CCC(CC2)NC(=O)c1nnc(Nc2ccc(F)c(F)c2)o1 \|(9.63,6.88,;8.3,6.11,;6.96,6.88,;8.3,4.57,;6.96,3.8,;5.63,4.57,;4.3,3.8,;4.3,2.26,;5.63,1.49,;6.96,2.26,;2.96,3.03,;1.63,2.26,;1.63,.72,;2.96,-.05,;4.3,.72,;.29,-.05,;.29,-1.59,;1.63,-2.36,;-1.04,-2.36,;-2.44,-1.74,;-3.48,-2.88,;-2.71,-4.21,;-3.48,-5.55,;-5.02,-5.55,;-5.79,-6.88,;-7.32,-6.88,;-8.09,-5.54,;-9.63,-5.54,;-7.33,-4.22,;-8.1,-2.88,;-5.79,-4.21,;-1.2,-3.89,)\|
BDBM50599919	OC(=O)CC1CCC2(CC1)CCC(CC2)c1ccc(NC(=O)c2nnc(Nc3ccc(F)c(F)c3)o2)cc1 \|(11.91,-4.2,;10.58,-3.43,;10.58,-1.89,;9.24,-4.2,;7.91,-3.43,;7.91,-1.89,;6.58,-1.12,;5.24,-1.89,;5.24,-3.43,;6.58,-4.2,;5.24,-.35,;3.91,.42,;2.58,-.35,;2.58,-1.89,;3.91,-2.66,;1.24,.42,;1.24,1.96,;-.09,2.73,;-1.42,1.96,;-2.75,2.73,;-4.09,1.96,;-4.09,.42,;-5.42,2.73,;-5.9,4.2,;-7.44,4.2,;-7.91,2.73,;-9.25,1.96,;-9.25,.42,;-7.91,-.35,;-7.92,-1.88,;-9.25,-2.65,;-9.25,-4.19,;-10.58,-1.89,;-11.91,-2.66,;-10.59,-.35,;-6.67,1.83,;-1.42,.42,;-.08,-.35,)\|
BDBM50599921	OC(=O)CC1CCC2(CC1)CCN(CC2)c1ccc(NC(=O)c2nnc(Nc3ccc(F)c(F)c3)o2)cn1
BDBM50599922	OC(=O)C1CC2(C1)CCC(CC2)c1ccc(NC(=O)c2nnc(Nc3ccc(F)c(F)c3)o2)cc1 \|(10.87,-2.43,;9.53,-3.2,;9.53,-4.74,;8.2,-2.43,;7.8,-.94,;6.29,-1.35,;6.69,-2.83,;6.29,.19,;4.95,.96,;3.62,.19,;3.62,-1.35,;4.95,-2.12,;2.29,.96,;2.29,2.5,;.96,3.27,;-.38,2.5,;-1.71,3.27,;-3.04,2.5,;-3.04,.96,;-4.38,3.27,;-4.85,4.74,;-6.39,4.74,;-6.87,3.27,;-8.2,2.5,;-8.2,.96,;-6.87,.19,;-6.87,-1.34,;-8.2,-2.11,;-8.2,-3.65,;-9.53,-1.35,;-10.87,-2.12,;-9.54,.19,;-5.62,2.37,;-.38,.96,;.96,.2,)\|
BDBM50599923	OC(=O)C1CC2(C1)CCN(CC2)c1ccc(NC(=O)c2nnc(Nc3ccc(F)c(F)c3)o2)cn1