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132 SMILES Strings for DNA polymerase alpha catalytic subunit

Compound NameSMILES String
BDBM20192 [H][C@@]1(CC[C@@]2([H])[C@]3([H])CC=C4C[C@@H](O)CC[C@]4(C)[C@@]3([H])CC[C@]12C)[C@H](C)CCCC(C)C |t:9|
BDBM23926 Oc1ccc(\C=C\c2cc(O)cc(O)c2)cc1
BDBM50001210 CC(=O)N[C@@H](Cc1ccccc1)C(=O)NP(O)(=O)OC[C@H]1O[C@@H](n2ccc(N)nc2=O)C(F)(F)[C@@H]1O |r|
BDBM50001143 CC(=O)NP(S)(=O)OC[C@H]1O[C@@H](n2ccc(N)nc2=O)C(F)(F)[C@@H]1O |r|
BDBM50001205 Nc1ccn([C@@H]2O[C@H](COP(O)(=O)NC(=O)c3ccccc3)[C@@H](O)C2(F)F)c(=O)n1 |r|
BDBM50001207 Nc1ccn([C@@H]2O[C@H](COP(O)(=O)NC(=O)c3ccncc3)[C@@H](O)C2(F)F)c(=O)n1 |r|
BDBM50001208 CC(=O)NP(O)(=O)OC[C@H]1O[C@@H](n2ccc(N)nc2=O)C(F)(F)[C@@H]1O |r|
BDBM50001141 Nc1ccn([C@@H]2O[C@H](COP(S)(=O)NC(=O)c3ccccc3)[C@@H](O)C2(F)F)c(=O)n1 |r|
BDBM50001142 Nc1ccn([C@@H]2O[C@H](COP(S)(=O)NC(=O)c3cccnc3)[C@@H](O)C2(F)F)c(=O)n1 |r|
BDBM50001204 CC(=O)N1CCC[C@H]1C(=O)NP(S)(=O)OC[C@H]1O[C@@H](n2ccc(N)nc2=O)C(F)(F)[C@@H]1O |r|
BDBM50001209 CC(=O)N1CCC[C@H]1C(=O)NP(O)(=O)OC[C@H]1O[C@@H](n2ccc(N)nc2=O)C(F)(F)[C@@H]1O |r|
BDBM50001206 Nc1ccn([C@@H]2O[C@H](COP(O)(=O)NC(=O)c3cccnc3)[C@@H](O)C2(F)F)c(=O)n1 |r|
BDBM50013074 CCCCc1ccc(Nc2nc3nc[nH]c3c(=O)[nH]2)cc1
BDBM50013075 O=c1[nH]c(Nc2ccc3CCCc3c2)nc2nc[nH]c12
BDBM50013091 Clc1ccc(Nc2nc3nc[nH]c3c(=O)[nH]2)cc1Cl
BDBM50013093 CCc1cc(Nc2nc3nc[nH]c3c(=O)[nH]2)ccc1C
BDBM50011181 OC(=O)P(O)(O)=O
BDBM50025592 CCCCc1ccc(Nc2nc(SC)c3[nH]cnc3n2)cc1
BDBM50025593 CCCCc1ccc(Nc2nc(N)c3[nH]cnc3n2)cc1
BDBM50025595 CCCCc1ccc(Nc2nc3nc[nH]c3c(=S)[nH]2)cc1
BDBM50025597 CCCCc1ccc(Nc2ncc3[nH]cnc3n2)cc1
BDBM50025598 CCCCc1ccc(Nc2nc(Cl)c3[nH]cnc3n2)cc1
BDBM50025600 CCCCc1ccc(Nc2nc(OC)c3[nH]cnc3n2)cc1
BDBM50034955 Nc1nc(Nc2ccc(Cl)c(Cl)c2)nc2nc[nH]c12
BDBM50034961 Nc1nc(Cl)cc(Nc2ccc(Cl)c(Cl)c2)n1
BDBM50042444 COc1ccc2CC[C@H]3C(C)(N)CCC[C@]3(C)c2c1
BDBM50042459 CC1(CO)[C@H](O)CC[C@@]2(C)[C@H]1CCc1ccc(O)cc21
BDBM50042445 COc1ccc2CC[C@H]3C(C)(CCC[C@]3(C)c2c1)C(O)=O
BDBM50042447 CC1(CO)[C@@H](O)CC[C@@]2(C)[C@H]1CCc1cc(CO)c(O)cc21
BDBM50042448 COC(=O)C1(C)CCC[C@@]2(C)[C@H]1CCc1cc(C=O)c(OC)cc21
BDBM50042449 CC1(CO)[C@H](O)CC[C@@]2(C)[C@H]1CCc1cc(CO)c(O)cc21
BDBM50042454 CC1(CCC[C@@]2(C)[C@H]1CCc1cc(C=O)c(O)cc21)C(O)=O
BDBM50042456 COc1cc2c(CC[C@H]3C(C)(CO)CCC[C@]23C)cc1CO
BDBM50090910 C[C@@]1(CO)[C@H](O)CC[C@@]2(C)[C@H]1CC[C@H]1C[C@@H]3C[C@]21CC[C@]3(O)CO |r|
BDBM50091995 Oc1cc2ccccc2cc1C(=O)Nc1cccc(c1)[N+]([O-])=O
BDBM50091980 Oc1cc2c(O)cccc2cc1C(=O)NCc1ccc(Cl)cc1
BDBM50091981 Oc1ccc2cc(O)c(cc2c1)C(=O)NCc1ccc(Cl)cc1
BDBM50091985 Oc1cc2c(O)cccc2cc1C(=O)NCc1ccc(cc1)[N+]([O-])=O
BDBM50091988 COc1ccc2cc(O)c(cc2c1)C(=O)NCc1ccc(cc1)[N+]([O-])=O
BDBM50091990 COc1ccc2cc(O)c(cc2c1)C(=O)Nc1nc2c(Cl)cccc2s1
BDBM50118822 CC(C)(C)C(=O)OCOP(=O)(OCOC(=O)C(C)(C)C)OC[C@H]1O[C@H](C[C@@H]1O)n1c(Br)nc2c(N)ncnc12
BDBM50118823 CC(C)(C)C(=O)OCOP(=O)(OCOC(=O)C(C)(C)C)OC[C@H]1OC(C[C@H]1O)n1nnc2c(N)ncnc12
BDBM50143526 CCCCCCCCCCCCCCCC[C@]1(O)C=CC(=O)[C@H]1C(=O)OC |c:18|
BDBM50225280 CCCCc1ccc(NC2=NC(=O)C3N=CN([C@H]4C[C@H](O)[C@@H](COP(O)(=O)OP(O)(=O)OP(O)(O)=O)O4)C3=N2)cc1 |r,c:14,39,t:9|
BDBM50150371 COC(=O)N(CC(O)=O)C(=O)c1c(Cl)ccc2c(c(OC)ccc12)C(F)(F)F
BDBM50153106 CC(C)CCC[C@@H](C)[C@H]1CCC2C3CC=C4C[C@H](CC[C@]4(C)C3CC[C@]12C)OCC(O)=O |t:14|
BDBM50153107 CC(C)CCC[C@@H](C)[C@H]1CCC2C3CC[C@H]4C[C@@H](O)CC[C@]4(C)C3CC[C@]12C
BDBM50153108 CC[C@H](\C=C\[C@@H](C)[C@H]1CCC2C3CC=C4C[C@H](CC[C@]4(C)C3CC[C@]12C)OC(O)CO)C(C)C |t:13|
BDBM50153109 CC[C@H](\C=C\[C@@H](C)[C@H]1CCC2C3CC=C4C[C@@H](O)CC[C@]4(C)C3CC[C@]12C)C(C)C |t:13|
BDBM50153110 CC(C)CCC[C@@H](C)[C@H]1CCC2C3CC[C@H]4C[C@H](CC[C@]4(C)C3CC[C@]12C)OCCO
BDBM50153111 CC(C)CCC[C@@H](C)[C@H]1CCC2C3CC[C@H]4C[C@H](CC[C@]4(C)C3CC[C@]12C)OCC(O)=O
BDBM50153112 CC(C)CCC[C@@H](C)[C@H]1CCC2C3CC=C4C[C@H](CC[C@]4(C)C3CC[C@]12C)OC(O)CO |t:14|
BDBM50153113 CC[C@H](\C=C\[C@@H](C)[C@H]1CCC2C3CC=C4C[C@H](CC[C@]4(C)C3CC[C@]12C)OCC(O)=O)C(C)C |t:13|
BDBM50153114 CC[C@H](\C=C\[C@@H](C)[C@H]1CCC2C3CC=C4C[C@H](CC[C@]4(C)C3CC[C@]12C)OCCO)C(C)C |t:13|
BDBM50153115 CC(C)CCC[C@@H](C)[C@H]1CCC2C3CC[C@H]4C[C@H](CC[C@]4(C)C3CC[C@]12C)OC(O)CO
BDBM50153117 C[C@@H](CCC(O)=O)[C@H]1CCC2C3CC[C@]4(C)CC(O)CC[C@]4(C)C3CC[C@]12C
BDBM50153118 CC(C)CCC[C@@H](C)[C@H]1CCC2C3CC=C4C[C@H](CC[C@]4(C)C3CC[C@]12C)OCCO |t:14|
BDBM50172514 Cn1cc(C(=O)NCc2ccc(Cl)cc2)c(=O)c2cc(CN3CCOCC3)sc12
BDBM50172517 OCCCc1ccc2ncc(C(=O)NCc3ccc(Cl)cc3)c(O)c2c1
BDBM50172518 Cn1cc(C(=O)NCc2ccc(Cl)cc2)c(=O)c2cc(CCCO)sc12
BDBM50172526 Cn1cc(C(=O)NCc2ccc(Cl)cc2)c(=O)c2cc(CN3CCOCC3)ccc12
BDBM50181559 Oc1c(C2=Nc3ccccc3S(=O)(=O)N2)c(=O)n(CCC2CC2)c2ccc(F)cc12 |t:3|
BDBM50181922 OC(=O)c1ccc2n(C3CCCCC3)c(nc2c1)-c1ccc(OC(c2cccc(F)c2)c2cccc(F)c2)cc1
BDBM50181923 OC(=O)c1ccc2n(C3CCCCC3)c(nc2c1)-c1ccc(OC(c2ccccc2)c2ccccc2)cc1
BDBM50181926 CN(C)C(=O)c1ccc(cc1)C(Oc1ccc(-c2nc3cc(ccc3n2C2CCCCC2)C(O)=O)c(F)c1)c1ccc(cc1)C(=O)N(C)C
BDBM50181927 OC(=O)c1ccc2n(C3CCCCC3)c(nc2c1)-c1ccc(OC(c2ccc(F)cc2)c2ccc(F)cc2)cc1F
BDBM50181929 Cc1ccc(cc1)C(Oc1ccc(cc1)-c1nc2cc(ccc2n1C1CCCCC1)C(O)=O)c1ccc(C)cc1
BDBM50181932 OC(=O)c1ccc2n(C3CCCCC3)c(nc2c1)-c1ccc(OC(c2ccc(Cl)cc2)c2ccc(Cl)cc2)cc1
BDBM50181933 OC(=O)c1ccc2n(C3CCCCC3)c(nc2c1)-c1ccc(OC(c2ccc(F)cc2)c2ccc(F)cc2)cc1
BDBM50181935 OC(=O)c1ccc2n(C3CCCCC3)c(nc2c1)-c1ccc(OC(c2cccnc2)c2cccnc2)cc1F
BDBM50181938 OC(=O)c1ccc2n(C3CCCCC3)c(nc2c1)-c1ccc(OC(c2ccccc2)c2cccnc2)cc1F
BDBM50181941 OC(=O)c1ccc2n(C3CCCCC3)c(nc2c1)-c1ccc(OC(c2ccccc2)c2ccccc2)cc1F
BDBM50184748 CCCCCCCCCCCCCCCCCC(=O)C=C1[C@H](O)[C@H]([C@H](CC)N1CCc1ccccc1)C(=O)OC |w:19.18|
BDBM50184749 CCCCCCCCCCCCC(=O)C=C1[C@H](O)[C@H]([C@H](CC)N1Cc1ccccc1)C(=O)OC |w:14.13|
BDBM50184750 CCCCCCCCCCCCCCCCCC(=O)C=C1[C@H](O)[C@H]([C@@H](N1CCc1ccccc1)c1ccccc1)C(=O)OC |w:19.18|
BDBM50184751 CCCCCCCCCCCCC(=O)C=C1[C@H](O)[C@H]([C@H](CC)N1CCc1ccccc1)C(=O)OC |w:14.13|
BDBM50184752 CCCCCCCCCCCCCCCCC1=C(C(=O)OC(C)C)C(=O)[C@H]2[C@@H]1[C@@H](C(=O)OC(C)C)C(CCCCCCCCCCCCCCCC)=C[C@@H]2C(O)=O |c:16,52|
BDBM50184753 CCCCCCCCCCCCCCCCC1=C[C@@H]([C@@H]2[C@H]([C@H]1C(=O)OC)[C@@]1(CCCCCCCCCCCCCCCC)C[C@@]1(C(=O)OC)C2=O)C(=O)OC |t:16|
BDBM50184754 CCCCCCCCCCCCCCCCC(=O)C=CC(=O)CC(=O)OC |w:18.17|
BDBM50184755 CCCCCCCCCCCCCCCCC1=C(C(=O)OC)C(=O)[C@H]2[C@@H]1[C@@H](C(=O)OC)C(CCCCCCCCCCCCCCCC)=C[C@@H]2C(O)=O |c:16,48|
BDBM50184756 CCCCCCCCCCCCCCCCC1=C(C(=O)OC)C(=O)[C@H]2[C@@H]1[C@H](C(=O)OC)C(CCCCCCCCCCCCCCCC)=C[C@@H]2C(=O)OCC |c:16,48|
BDBM50184757 CCCCCCCCCCCCCCCCC1=C(C(=O)OC)C(=O)[C@H]2[C@@H]1[C@@H](C(=O)OC)C(CCCCCCCCCCCCCCCC)=C[C@@H]2C(=O)OCC |c:16,48|
BDBM50184758 CCCCCCCCCCCCC1=C(C(=O)OC)C(=O)[C@H]2[C@@H]1[C@@H](C(=O)OC)C(CCCCCCCCCCCC)=C[C@@H]2C(O)=O |c:12,40|
BDBM50184759 CCCCCCCCCCCCC(=O)C=C1[C@H](O)[C@H]([C@@H](N1CCc1c[nH]c2ccccc12)c1ccccc1)C(=O)OC |w:14.13|
BDBM50184760 CCCCCCCCCCCCC(=O)C=C1[C@@H](O)[C@H]([C@H](CC)N1Cc1ccccc1)C(=O)OC |w:14.13|
BDBM50184761 CCCCCCCCCCCCCCCCC1=C(C(=O)OC)C(=O)[C@H]2[C@@H]1[C@@H](C(=O)OC)C(CCCCCCCCCCCCCCCC)=C[C@@H]2C(=O)NCCc1ccccc1 |c:16,48|
BDBM50184762 CCCCCCCCCCCCCCCC[C@]1(O)C=C[C@H](O)[C@H]1C(=O)OC |c:18|
BDBM50184763 CCC1=C(C(=O)OC)C(=O)[C@H]2[C@@H]1[C@@H](C(=O)OC)C(CC)=C[C@@H]2C(O)=O |c:2,20|
BDBM50187225 Cc1cc(c(N)cc1Cl)S(=O)(=O)N1CCC[C@H]1C(O)=O
BDBM50191511 OC(=O)c1ccc2n(C3CCCCC3)c(nc2c1)-c1ccc(OCc2cc(ccc2-c2ccc(Cl)cc2)N2CCCC2=O)cc1F
BDBM50205415 Cc1cn([C@@H]2O[C@H](COP(O)(=O)OP(O)(=O)OP(O)(O)=O)[C@@H](O)[C@H]2O)c(=O)[nH]c1=O
BDBM50293303 OC(=O)c1cc(O)c(O)c(OC(=O)c2ccc(O)c(O)c2O)c1
BDBM50300193 OC(=O)c1ccccc1NS(=O)(=O)c1cccc(c1)-c1cnn(Cc2ccccc2)c1
BDBM50300194 OC(=O)c1ccc(F)cc1NS(=O)(=O)c1cccc(c1)-c1cnn(Cc2ccccc2)c1
BDBM50300195 OC(=O)c1ccc(F)cc1NS(=O)(=O)c1cccc(c1)-c1cnn(Cc2ccc3ccccc3c2)c1
BDBM50318169 OCCc1cc2cc(CN3CCOCC3)cc3c2n1cc(C(=O)NCc1ccc(Cl)cc1)c3=O
BDBM50318170 OCCOCc1cc2cc(CN3CCOCC3)cc3c2n1cc(C(=O)NCc1ccc(Cl)cc1)c3=O
BDBM50318171 OCCN(CCO)CCc1cc2cc(CN3CCOCC3)cc3c2n1cc(C(=O)NCc1ccc(Cl)cc1)c3=O
BDBM50318172 Clc1ccc(CNC(=O)c2cn3c(CCN4CCOCC4)cc4cc(CN5CCOCC5)cc(c34)c2=O)cc1
BDBM50313783 CN1C(=O)Cn2cc(C(=O)NCc3ccc(Cl)cc3)c(=O)c3cc(CN4CCOCC4)cc1c23
BDBM50313784 CN(C[C@@H](O)c1cc2ccccc2o1)Cc1cc2N(C)C(=O)Cn3cc(C(=O)NCc4ccc(Cl)cc4)c(=O)c(c1)c23 |r|
BDBM50333129 C[C@@]1(F)[C@H](O)[C@@H](COP(O)(=O)OP(O)(=O)OP(O)(O)=O)O[C@H]1n1ccc(=O)[nH]c1=O |r|
BDBM50333127 Nc1ccn([C@H]2CC[C@H](O2)[C@@H](F)OP(O)(=O)OP(O)(=O)OP(O)(O)=O)c(=O)n1 |r|
BDBM50335553 Nc1nc2n(CCOCP(O)(=O)OP(O)(O)=O)cnc2c(=O)[nH]1
BDBM50335554 Nc1nc2n(CCOCP(O)(=O)OP(O)(=O)OP(O)(O)=O)cnc2c(=O)[nH]1
BDBM50335555 Nc1nc(NC2CC2)c2ncn(CCOCP(O)(=O)OP(O)(O)=O)c2n1
BDBM50335556 Nc1nc(NC2CC2)c2ncn(CCOCP(O)(=O)OP(O)(=O)OP(O)(O)=O)c2n1
BDBM50336502 CC(=O)N1C(C2C(=O)CC(C)(C)CC2=Nc2ccccc12)c1ccc(Cl)cc1Cl |c:14|
BDBM50336503 COc1ccc(cc1OCc1ccccc1)C1C2C(=O)CC(C)(C)CC2=Nc2ccccc2N1C(C)=O |c:28|
BDBM50370476 Cc1cn([C@H]2C[C@H](N=[N+]=[N-])[C@@H](CO[P@@](O)(=O)O[P@@](O)(=O)OP(O)(O)=O)O2)c(=O)[nH]c1=O |r|
BDBM50408425 Nc1ccn([C@@H]2C[C@@H](F)[C@H](COP(O)(=O)OP(O)(=O)OP(O)(O)=O)O2)c(=O)n1 |r|
BDBM50408426 Cc1cn([C@@H]2C[C@@H](F)[C@H](COP(O)(=O)OP(O)(=O)OP(O)(O)=O)O2)c(=O)[nH]c1=O |r|
BDBM50408427 Cc1cn([C@@H]2C[C@@H](F)[C@H](COP(O)(=O)OP(O)(=O)OP(O)(O)=O)O2)c(=O)nc1N |r|
BDBM50408428 OP(O)(=O)OP(O)(=O)OP(O)(=O)OC[C@@H]1O[C@@H](C[C@H]1F)n1ccc(=O)[nH]c1=O |r|
BDBM50405103 CCCCc1ccc(Nc2nc3n(cnc3c(=O)[nH]2)[C@H]2C[C@H](O)[C@@H](CO)O2)cc1 |r|
BDBM50448688 CCCC[C@@H](O)\C=C(/C)\C=C\C=C\C(=O)N1CCCC1=O |r|
BDBM50448689 CCCC[C@@H](O)\C=C(/C)\C=C\C=C/C(=O)N1CCCC1=O |r|
BDBM50448690 CCCCC(=O)C=C(C)C=CCCC(=O)N1CCCC1=O |w:6.5,9.8|
BDBM50448691 C\C(\C=C\CCC(=O)N1CCCC1=O)=C/C1CCCCO1
BDBM50021053 C[C@@]1(O)[C@H](O)[C@@H](COP(O)(=O)OP(O)(=O)OP(O)(O)=O)O[C@H]1c1ccc2c(N)ncnn12 |r|
BDBM50231343 [H][C@@]12CCc3cc(CO)c(OC)cc3[C@@]1(C)CCC[C@@]2(C)C(O)=O
BDBM50231344 [H][C@]1(O)CC[C@]2(C)c3cc(OC)ccc3CC[C@@]2([H])[C@]1(C)CO
BDBM50231345 [H][C@@]12CCc3cc(CO)c(O)cc3[C@@]1(C)CCC[C@@]2(C)CO
BDBM50231383 [H][C@]1(O)CC[C@]2(C)c3cc(O)ccc3CC[C@@]2([H])[C@]1(C)CO
BDBM50231384 [H][C@@]12CCc3cc(CO)c(O)cc3[C@@]1(C)CCC[C@@]2(C)C(O)=O
BDBM50231386 [H][C@@]12CCc3cc(CO)c(OC)cc3[C@@]1(C)CCC[C@@]2(C)C(=O)OC
BDBM50231388 [H][C@@]1(O)CC[C@]2(C)c3cc(OC)ccc3CC[C@@]2([H])[C@]1(C)CO
BDBM50236025 Nc1ncnn2c(ccc12)[C@@]1(O[C@H](COP(O)(=O)OP(O)(=O)OP(O)(O)=O)[C@@H](O)[C@H]1O)C#N |r|
BDBM50239939 O[C@@H]1[C@@H](COP(O)(=O)OP(O)(=O)OP(O)(O)=O)O[C@@H](n2ccc(=O)[nH]c2=O)[C@@]1(F)Cl |r|
BDBM50261285 C[C@@]1(Cl)[C@H](O)[C@@H](COP(O)(=O)OP(O)(=O)OP(O)(O)=O)O[C@H]1n1ccc(=O)[nH]c1=O |r|
BDBM50268397 [H][C@@]12C[C@@]1(Cn1c(c(C3CCCCC3)c3ccc(cc13)C(=O)NS(=O)(=O)C1(C)CC1)-c1ccc(F)cc21)C(=O)N1C2CCC1CN(C)C2 |r,TLB:37:39:47.45.44:41.42,THB:46:45:39:41.42|
BDBM50591035 Nc1ccc(nn1)C#CCN(C(=O)Cc1ncc(cc1C(F)(F)F)C(F)(F)F)c1ccc(F)cc1