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PubMed code 19361209

Compile data set for download or QSAR
Found 30 hits of Enzyme Inhibition Constant Data   
Target/Host
(Institution)		LigandTarget/Host
Links		Ligand
Links		Trg + Lig
Links		Ki
nM		ΔG°
kJ/mole		IC50
nM		Kd
nM		EC50/IC50
nM		koff
s-1		kon
M-1s-1		pHTemp
°C
Corticotropin-releasing factor receptor 1


(Rattus norvegicus (rat))		BDBM29500
PNG
(Pyrazolo[1,5-a]-1,3,5-triazine, 13-25)
Show SMILES CCCN(CC1CC1)c1nc(C)nc2c(c(C)nn12)-c1ccc(OC)nc1C |(1.82,10.01,;.34,9.62,;-.06,8.13,;-1.57,7.83,;-2.59,8.98,;-2.1,10.44,;-2.05,11.98,;-.74,11.17,;-2.07,6.37,;-3.58,6.06,;-4.07,4.61,;-5.58,4.3,;-3.05,3.45,;-1.54,3.75,;-.31,2.83,;.95,3.72,;2.41,3.23,;.49,5.19,;-1.05,5.21,;-.33,1.29,;-1.66,.52,;-1.66,-1.02,;-.33,-1.79,;-.33,-3.33,;1.01,-4.1,;1.01,-1.02,;1.01,.52,;2.34,1.29,)|
Show InChI InChI=1S/C21H28N6O/c1-6-11-26(12-16-7-8-16)21-24-15(4)23-20-19(14(3)25-27(20)21)17-9-10-18(28-5)22-13(17)2/h9-10,16H,6-8,11-12H2,1-5H3
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n/an/a 1.60n/an/an/an/a7.223



Bristol-Myers Squibb Company



Assay Description
Naive rats were sacrificed by decapitation, and the brain and pituitary were collected. Slide-mounted brain sections were preincubated in an assay so...

J Med Chem 52: 3084-92 (2009)


Article DOI: 10.1021/jm900025h
BindingDB Entry DOI: 10.7270/Q20000D0
More data for this
Ligand-Target Pair
Corticotropin-releasing factor receptor 1


(Rattus norvegicus (rat))		BDBM29505
PNG
(Pyrazolo[1,5-a]-1,3,5-triazine, 13-30)
Show SMILES CCCCN(CCC)c1nc(C)nc2c(c(C)nn12)-c1ccc(OC)nc1C |(2.22,11.5,;1.82,10.01,;.34,9.62,;-.06,8.13,;-1.57,7.83,;-2.59,8.98,;-2.1,10.44,;-3.11,11.6,;-2.07,6.37,;-3.58,6.06,;-4.07,4.61,;-5.58,4.3,;-3.05,3.45,;-1.54,3.75,;-.31,2.83,;.95,3.72,;2.41,3.23,;.49,5.19,;-1.05,5.21,;-.33,1.29,;-1.66,.52,;-1.66,-1.02,;-.33,-1.79,;-.33,-3.33,;1.01,-4.1,;1.01,-1.02,;1.01,.52,;2.34,1.29,)|
Show InChI InChI=1S/C21H30N6O/c1-7-9-13-26(12-8-2)21-24-16(5)23-20-19(15(4)25-27(20)21)17-10-11-18(28-6)22-14(17)3/h10-11H,7-9,12-13H2,1-6H3
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n/an/a 2.40n/an/an/an/a7.223



Bristol-Myers Squibb Company



Assay Description
Naive rats were sacrificed by decapitation, and the brain and pituitary were collected. Slide-mounted brain sections were preincubated in an assay so...

J Med Chem 52: 3084-92 (2009)


Article DOI: 10.1021/jm900025h
BindingDB Entry DOI: 10.7270/Q20000D0
More data for this
Ligand-Target Pair
Corticotropin-releasing factor receptor 1


(Rattus norvegicus (rat))		BDBM29488
PNG
(Pyrazolo[1,5-a]-1,3,5-triazine, 13-13)
Show SMILES CCC(CC)Nc1nc(C)nc2c(c(C)nn12)-c1cnc(OC)cc1C |(2.48,7.4,;.99,7,;-.06,8.13,;.34,9.62,;1.82,10.01,;-1.57,7.83,;-2.07,6.37,;-3.58,6.06,;-4.07,4.61,;-5.58,4.3,;-3.05,3.45,;-1.54,3.75,;-.31,2.83,;.95,3.72,;2.41,3.23,;.49,5.19,;-1.05,5.21,;-.33,1.29,;1.01,.52,;1.01,-1.02,;-.33,-1.79,;-.33,-3.33,;1.01,-4.1,;-1.66,-1.02,;-1.66,.52,;-2.99,1.29,)|
Show InChI InChI=1S/C19H26N6O/c1-7-14(8-2)23-19-22-13(5)21-18-17(12(4)24-25(18)19)15-10-20-16(26-6)9-11(15)3/h9-10,14H,7-8H2,1-6H3,(H,21,22,23)
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n/an/a 3n/an/an/an/a7.223



Bristol-Myers Squibb Company



Assay Description
Naive rats were sacrificed by decapitation, and the brain and pituitary were collected. Slide-mounted brain sections were preincubated in an assay so...

J Med Chem 52: 3084-92 (2009)


Article DOI: 10.1021/jm900025h
BindingDB Entry DOI: 10.7270/Q20000D0
More data for this
Ligand-Target Pair
Corticotropin-releasing factor receptor 1


(Rattus norvegicus (rat))		BDBM29499
PNG
(Pyrazolo[1,5-a]-1,3,5-triazine, 13-24)
Show SMILES COCCN(CC1CC1)c1nc(C)nc2c(c(C)nn12)-c1ccc(OC)nc1C |(2.22,11.5,;1.82,10.01,;.34,9.62,;-.06,8.13,;-1.57,7.83,;-2.59,8.98,;-2.1,10.44,;-2.05,11.98,;-.74,11.17,;-2.07,6.37,;-3.58,6.06,;-4.07,4.61,;-5.58,4.3,;-3.05,3.45,;-1.54,3.75,;-.31,2.83,;.95,3.72,;2.41,3.23,;.49,5.19,;-1.05,5.21,;-.33,1.29,;-1.66,.52,;-1.66,-1.02,;-.33,-1.79,;-.33,-3.33,;1.01,-4.1,;1.01,-1.02,;1.01,.52,;2.34,1.29,)|
Show InChI InChI=1S/C21H28N6O2/c1-13-17(8-9-18(22-13)29-5)19-14(2)25-27-20(19)23-15(3)24-21(27)26(10-11-28-4)12-16-6-7-16/h8-9,16H,6-7,10-12H2,1-5H3
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n/an/a 3.10n/an/an/an/a7.223



Bristol-Myers Squibb Company



Assay Description
Naive rats were sacrificed by decapitation, and the brain and pituitary were collected. Slide-mounted brain sections were preincubated in an assay so...

J Med Chem 52: 3084-92 (2009)


Article DOI: 10.1021/jm900025h
BindingDB Entry DOI: 10.7270/Q20000D0
More data for this
Ligand-Target Pair
Corticotropin-releasing factor receptor 1


(Rattus norvegicus (rat))		BDBM29489
PNG
(Pyrazolo[1,5-a]-1,3,5-triazine, 13-14)
Show SMILES CCC(CC)Nc1nc(C)nc2c(c(C)nn12)-c1ccc(OC)nc1C |(2.48,7.4,;.99,7,;-.06,8.13,;.34,9.62,;1.82,10.01,;-1.57,7.83,;-2.07,6.37,;-3.58,6.06,;-4.07,4.61,;-5.58,4.3,;-3.05,3.45,;-1.54,3.75,;-.31,2.83,;.95,3.72,;2.41,3.23,;.49,5.19,;-1.05,5.21,;-.33,1.29,;-1.66,.52,;-1.66,-1.02,;-.33,-1.79,;-.33,-3.33,;1.01,-4.1,;1.01,-1.02,;1.01,.52,;2.34,1.29,)|
Show InChI InChI=1S/C19H26N6O/c1-7-14(8-2)23-19-22-13(5)21-18-17(12(4)24-25(18)19)15-9-10-16(26-6)20-11(15)3/h9-10,14H,7-8H2,1-6H3,(H,21,22,23)
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n/an/a 3.10n/an/an/an/a7.223



Bristol-Myers Squibb Company



Assay Description
Naive rats were sacrificed by decapitation, and the brain and pituitary were collected. Slide-mounted brain sections were preincubated in an assay so...

J Med Chem 52: 3084-92 (2009)


Article DOI: 10.1021/jm900025h
BindingDB Entry DOI: 10.7270/Q20000D0
More data for this
Ligand-Target Pair
Corticotropin-releasing factor receptor 1


(Rattus norvegicus (rat))		BDBM29493
PNG
(Pyrazolo[1,5-a]-1,3,5-triazine, 13-18)
Show SMILES CCCC(C)Nc1nc(C)nc2c(c(C)nn12)-c1ccc(OC)nc1C |(3.57,6.31,;2.48,7.4,;.99,7,;-.06,8.13,;.34,9.62,;-1.57,7.83,;-2.07,6.37,;-3.58,6.06,;-4.07,4.61,;-5.58,4.3,;-3.05,3.45,;-1.54,3.75,;-.31,2.83,;.95,3.72,;2.41,3.23,;.49,5.19,;-1.05,5.21,;-.33,1.29,;-1.66,.52,;-1.66,-1.02,;-.33,-1.79,;-.33,-3.33,;1.01,-4.1,;1.01,-1.02,;1.01,.52,;2.34,1.29,)|
Show InChI InChI=1S/C19H26N6O/c1-7-8-11(2)20-19-23-14(5)22-18-17(13(4)24-25(18)19)15-9-10-16(26-6)21-12(15)3/h9-11H,7-8H2,1-6H3,(H,20,22,23)
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n/an/a 3.5n/an/an/an/a7.223



Bristol-Myers Squibb Company



Assay Description
Naive rats were sacrificed by decapitation, and the brain and pituitary were collected. Slide-mounted brain sections were preincubated in an assay so...

J Med Chem 52: 3084-92 (2009)


Article DOI: 10.1021/jm900025h
BindingDB Entry DOI: 10.7270/Q20000D0
More data for this
Ligand-Target Pair
Corticotropin-releasing factor receptor 1


(Rattus norvegicus (rat))		BDBM29492
PNG
(Pyrazolo[1,5-a]-1,3,5-triazine, 13-17)
Show SMILES CCC[C@H](C)Nc1nc(C)nc2c(c(C)nn12)-c1ccc(OC)nc1C |r,wU:3.3,(3.57,6.31,;2.48,7.4,;.99,7,;-.06,8.13,;.34,9.62,;-1.57,7.83,;-2.07,6.37,;-3.58,6.06,;-4.07,4.61,;-5.58,4.3,;-3.05,3.45,;-1.54,3.75,;-.31,2.83,;.95,3.72,;2.41,3.23,;.49,5.19,;-1.05,5.21,;-.33,1.29,;-1.66,.52,;-1.66,-1.02,;-.33,-1.79,;-.33,-3.33,;1.01,-4.1,;1.01,-1.02,;1.01,.52,;2.34,1.29,)|
Show InChI InChI=1S/C19H26N6O/c1-7-8-11(2)20-19-23-14(5)22-18-17(13(4)24-25(18)19)15-9-10-16(26-6)21-12(15)3/h9-11H,7-8H2,1-6H3,(H,20,22,23)/t11-/m0/s1
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n/an/a 4.5n/an/an/an/a7.223



Bristol-Myers Squibb Company



Assay Description
Naive rats were sacrificed by decapitation, and the brain and pituitary were collected. Slide-mounted brain sections were preincubated in an assay so...

J Med Chem 52: 3084-92 (2009)


Article DOI: 10.1021/jm900025h
BindingDB Entry DOI: 10.7270/Q20000D0
More data for this
Ligand-Target Pair
Corticotropin-releasing factor receptor 1


(Rattus norvegicus (rat))		BDBM29504
PNG
(Pyrazolo[1,5-a]-1,3,5-triazine, 13-29)
Show SMILES CCCCN(CC)c1nc(C)nc2c(c(C)nn12)-c1ccc(OC)nc1C |(2.22,11.5,;1.82,10.01,;.34,9.62,;-.06,8.13,;-1.57,7.83,;-2.59,8.98,;-2.1,10.44,;-2.07,6.37,;-3.58,6.06,;-4.07,4.61,;-5.58,4.3,;-3.05,3.45,;-1.54,3.75,;-.31,2.83,;.95,3.72,;2.41,3.23,;.49,5.19,;-1.05,5.21,;-.33,1.29,;-1.66,.52,;-1.66,-1.02,;-.33,-1.79,;-.33,-3.33,;1.01,-4.1,;1.01,-1.02,;1.01,.52,;2.34,1.29,)|
Show InChI InChI=1S/C20H28N6O/c1-7-9-12-25(8-2)20-23-15(5)22-19-18(14(4)24-26(19)20)16-10-11-17(27-6)21-13(16)3/h10-11H,7-9,12H2,1-6H3
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n/an/a 4.90n/an/an/an/a7.223



Bristol-Myers Squibb Company



Assay Description
Naive rats were sacrificed by decapitation, and the brain and pituitary were collected. Slide-mounted brain sections were preincubated in an assay so...

J Med Chem 52: 3084-92 (2009)


Article DOI: 10.1021/jm900025h
BindingDB Entry DOI: 10.7270/Q20000D0
More data for this
Ligand-Target Pair
Corticotropin-releasing factor receptor 1


(Rattus norvegicus (rat))		BDBM29494
PNG
(Pyrazolo[1,5-a]-1,3,5-triazine, 13-19)
Show SMILES CCCCC(C)Nc1nc(C)nc2c(c(C)nn12)-c1ccc(OC)nc1C |(5.06,6.71,;3.57,6.31,;2.48,7.4,;.99,7,;-.06,8.13,;.34,9.62,;-1.57,7.83,;-2.07,6.37,;-3.58,6.06,;-4.07,4.61,;-5.58,4.3,;-3.05,3.45,;-1.54,3.75,;-.31,2.83,;.95,3.72,;2.41,3.23,;.49,5.19,;-1.05,5.21,;-.33,1.29,;-1.66,.52,;-1.66,-1.02,;-.33,-1.79,;-.33,-3.33,;1.01,-4.1,;1.01,-1.02,;1.01,.52,;2.34,1.29,)|
Show InChI InChI=1S/C20H28N6O/c1-7-8-9-12(2)21-20-24-15(5)23-19-18(14(4)25-26(19)20)16-10-11-17(27-6)22-13(16)3/h10-12H,7-9H2,1-6H3,(H,21,23,24)
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n/an/a 5.10n/an/an/an/a7.223



Bristol-Myers Squibb Company



Assay Description
Naive rats were sacrificed by decapitation, and the brain and pituitary were collected. Slide-mounted brain sections were preincubated in an assay so...

J Med Chem 52: 3084-92 (2009)


Article DOI: 10.1021/jm900025h
BindingDB Entry DOI: 10.7270/Q20000D0
More data for this
Ligand-Target Pair
Corticotropin-releasing factor receptor 1


(Rattus norvegicus (rat))		BDBM29496
PNG
(Pyrazolo[1,5-a]-1,3,5-triazine, 13-21)
Show SMILES CCCN(CCC)c1nc(C)nc2c(c(C)nn12)-c1ccc(OC)nc1C |(-3.11,11.6,;-2.1,10.44,;-2.59,8.98,;-1.57,7.83,;-.06,8.13,;.34,9.62,;1.82,10.01,;-2.07,6.37,;-3.58,6.06,;-4.07,4.61,;-5.58,4.3,;-3.05,3.45,;-1.54,3.75,;-.31,2.83,;.95,3.72,;2.41,3.23,;.49,5.19,;-1.05,5.21,;-.33,1.29,;-1.66,.52,;-1.66,-1.02,;-.33,-1.79,;-.33,-3.33,;1.01,-4.1,;1.01,-1.02,;1.01,.52,;2.34,1.29,)|
Show InChI InChI=1S/C20H28N6O/c1-7-11-25(12-8-2)20-23-15(5)22-19-18(14(4)24-26(19)20)16-9-10-17(27-6)21-13(16)3/h9-10H,7-8,11-12H2,1-6H3
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n/an/a 5.70n/an/an/an/a7.223



Bristol-Myers Squibb Company



Assay Description
Naive rats were sacrificed by decapitation, and the brain and pituitary were collected. Slide-mounted brain sections were preincubated in an assay so...

J Med Chem 52: 3084-92 (2009)


Article DOI: 10.1021/jm900025h
BindingDB Entry DOI: 10.7270/Q20000D0
More data for this
Ligand-Target Pair
Corticotropin-releasing factor receptor 1


(Rattus norvegicus (rat))		BDBM29490
PNG
(Pyrazolo[1,5-a]-1,3,5-triazine, 13-15)
Show SMILES CC[C@@H](C)Nc1nc(C)nc2c(c(C)nn12)-c1ccc(OC)nc1C |r,wD:2.2,(2.48,7.4,;.99,7,;-.06,8.13,;.34,9.62,;-1.57,7.83,;-2.07,6.37,;-3.58,6.06,;-4.07,4.61,;-5.58,4.3,;-3.05,3.45,;-1.54,3.75,;-.31,2.83,;.95,3.72,;2.41,3.23,;.49,5.19,;-1.05,5.21,;-.33,1.29,;-1.66,.52,;-1.66,-1.02,;-.33,-1.79,;-.33,-3.33,;1.01,-4.1,;1.01,-1.02,;1.01,.52,;2.34,1.29,)|
Show InChI InChI=1S/C18H24N6O/c1-7-10(2)19-18-22-13(5)21-17-16(12(4)23-24(17)18)14-8-9-15(25-6)20-11(14)3/h8-10H,7H2,1-6H3,(H,19,21,22)/t10-/m1/s1
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n/an/a 6.10n/an/an/an/a7.223



Bristol-Myers Squibb Company



Assay Description
Naive rats were sacrificed by decapitation, and the brain and pituitary were collected. Slide-mounted brain sections were preincubated in an assay so...

J Med Chem 52: 3084-92 (2009)


Article DOI: 10.1021/jm900025h
BindingDB Entry DOI: 10.7270/Q20000D0
More data for this
Ligand-Target Pair
Corticotropin-releasing factor receptor 1


(Rattus norvegicus (rat))		BDBM29498
PNG
(Pyrazolo[1,5-a]-1,3,5-triazine, 13-23)
Show SMILES CCN(CCOC)c1nc(C)nc2c(c(C)nn12)-c1ccc(OC)nc1C |(-2.1,10.44,;-2.59,8.98,;-1.57,7.83,;-.06,8.13,;.34,9.62,;1.82,10.01,;2.22,11.5,;-2.07,6.37,;-3.58,6.06,;-4.07,4.61,;-5.58,4.3,;-3.05,3.45,;-1.54,3.75,;-.31,2.83,;.95,3.72,;2.41,3.23,;.49,5.19,;-1.05,5.21,;-.33,1.29,;-1.66,.52,;-1.66,-1.02,;-.33,-1.79,;-.33,-3.33,;1.01,-4.1,;1.01,-1.02,;1.01,.52,;2.34,1.29,)|
Show InChI InChI=1S/C19H26N6O2/c1-7-24(10-11-26-5)19-22-14(4)21-18-17(13(3)23-25(18)19)15-8-9-16(27-6)20-12(15)2/h8-9H,7,10-11H2,1-6H3
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Bristol-Myers Squibb Company



Assay Description
Naive rats were sacrificed by decapitation, and the brain and pituitary were collected. Slide-mounted brain sections were preincubated in an assay so...

J Med Chem 52: 3084-92 (2009)


Article DOI: 10.1021/jm900025h
BindingDB Entry DOI: 10.7270/Q20000D0
More data for this
Ligand-Target Pair
Corticotropin-releasing factor receptor 1


(Rattus norvegicus (rat))		BDBM29491
PNG
(Pyrazolo[1,5-a]-1,3,5-triazine, 13-16)
Show SMILES CC[C@H](C)Nc1nc(C)nc2c(c(C)nn12)-c1ccc(OC)nc1C |r,wU:2.2,(2.48,7.4,;.99,7,;-.06,8.13,;.34,9.62,;-1.57,7.83,;-2.07,6.37,;-3.58,6.06,;-4.07,4.61,;-5.58,4.3,;-3.05,3.45,;-1.54,3.75,;-.31,2.83,;.95,3.72,;2.41,3.23,;.49,5.19,;-1.05,5.21,;-.33,1.29,;-1.66,.52,;-1.66,-1.02,;-.33,-1.79,;-.33,-3.33,;1.01,-4.1,;1.01,-1.02,;1.01,.52,;2.34,1.29,)|
Show InChI InChI=1S/C18H24N6O/c1-7-10(2)19-18-22-13(5)21-17-16(12(4)23-24(17)18)14-8-9-15(25-6)20-11(14)3/h8-10H,7H2,1-6H3,(H,19,21,22)/t10-/m0/s1
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n/an/a 7n/an/an/an/a7.223



Bristol-Myers Squibb Company



Assay Description
Naive rats were sacrificed by decapitation, and the brain and pituitary were collected. Slide-mounted brain sections were preincubated in an assay so...

J Med Chem 52: 3084-92 (2009)


Article DOI: 10.1021/jm900025h
BindingDB Entry DOI: 10.7270/Q20000D0
More data for this
Ligand-Target Pair
Corticotropin-releasing factor receptor 1


(Rattus norvegicus (rat))		BDBM29503
PNG
(Pyrazolo[1,5-a]-1,3,5-triazine, 13-28)
Show SMILES CCCCN(C)c1nc(C)nc2c(c(C)nn12)-c1ccc(OC)nc1C |(2.22,11.5,;1.82,10.01,;.34,9.62,;-.06,8.13,;-1.57,7.83,;-2.59,8.98,;-2.07,6.37,;-3.58,6.06,;-4.07,4.61,;-5.58,4.3,;-3.05,3.45,;-1.54,3.75,;-.31,2.83,;.95,3.72,;2.41,3.23,;.49,5.19,;-1.05,5.21,;-.33,1.29,;-1.66,.52,;-1.66,-1.02,;-.33,-1.79,;-.33,-3.33,;1.01,-4.1,;1.01,-1.02,;1.01,.52,;2.34,1.29,)|
Show InChI InChI=1S/C19H26N6O/c1-7-8-11-24(5)19-22-14(4)21-18-17(13(3)23-25(18)19)15-9-10-16(26-6)20-12(15)2/h9-10H,7-8,11H2,1-6H3
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n/an/a 8.10n/an/an/an/a7.223



Bristol-Myers Squibb Company



Assay Description
Naive rats were sacrificed by decapitation, and the brain and pituitary were collected. Slide-mounted brain sections were preincubated in an assay so...

J Med Chem 52: 3084-92 (2009)


Article DOI: 10.1021/jm900025h
BindingDB Entry DOI: 10.7270/Q20000D0
More data for this
Ligand-Target Pair
Corticotropin-releasing factor receptor 1


(Rattus norvegicus (rat))		BDBM29497
PNG
(Pyrazolo[1,5-a]-1,3,5-triazine, 13-22)
Show SMILES COCCN(CCOC)c1nc(C)nc2c(c(C)nn12)-c1ccc(OC)nc1C |(-2.62,13.06,;-3.11,11.6,;-2.1,10.44,;-2.59,8.98,;-1.57,7.83,;-.06,8.13,;.34,9.62,;1.82,10.01,;2.22,11.5,;-2.07,6.37,;-3.58,6.06,;-4.07,4.61,;-5.58,4.3,;-3.05,3.45,;-1.54,3.75,;-.31,2.83,;.95,3.72,;2.41,3.23,;.49,5.19,;-1.05,5.21,;-.33,1.29,;-1.66,.52,;-1.66,-1.02,;-.33,-1.79,;-.33,-3.33,;1.01,-4.1,;1.01,-1.02,;1.01,.52,;2.34,1.29,)|
Show InChI InChI=1S/C20H28N6O3/c1-13-16(7-8-17(21-13)29-6)18-14(2)24-26-19(18)22-15(3)23-20(26)25(9-11-27-4)10-12-28-5/h7-8H,9-12H2,1-6H3
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n/an/a 8.5n/an/an/an/a7.223



Bristol-Myers Squibb Company



Assay Description
Naive rats were sacrificed by decapitation, and the brain and pituitary were collected. Slide-mounted brain sections were preincubated in an assay so...

J Med Chem 52: 3084-92 (2009)


Article DOI: 10.1021/jm900025h
BindingDB Entry DOI: 10.7270/Q20000D0
More data for this
Ligand-Target Pair
Corticotropin-releasing factor receptor 1


(Rattus norvegicus (rat))		BDBM29495
PNG
(Pyrazolo[1,5-a]-1,3,5-triazine, 13-20)
Show SMILES CCN(CC)c1nc(C)nc2c(c(C)nn12)-c1ccc(OC)nc1C |(.34,9.62,;-.06,8.13,;-1.57,7.83,;-2.59,8.98,;-2.1,10.44,;-2.07,6.37,;-3.58,6.06,;-4.07,4.61,;-5.58,4.3,;-3.05,3.45,;-1.54,3.75,;-.31,2.83,;.95,3.72,;2.41,3.23,;.49,5.19,;-1.05,5.21,;-.33,1.29,;-1.66,.52,;-1.66,-1.02,;-.33,-1.79,;-.33,-3.33,;1.01,-4.1,;1.01,-1.02,;1.01,.52,;2.34,1.29,)|
Show InChI InChI=1S/C18H24N6O/c1-7-23(8-2)18-21-13(5)20-17-16(12(4)22-24(17)18)14-9-10-15(25-6)19-11(14)3/h9-10H,7-8H2,1-6H3
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n/an/a 12n/an/an/an/a7.223



Bristol-Myers Squibb Company



Assay Description
Naive rats were sacrificed by decapitation, and the brain and pituitary were collected. Slide-mounted brain sections were preincubated in an assay so...

J Med Chem 52: 3084-92 (2009)


Article DOI: 10.1021/jm900025h
BindingDB Entry DOI: 10.7270/Q20000D0
More data for this
Ligand-Target Pair
Corticotropin-releasing factor receptor 1


(Rattus norvegicus (rat))		BDBM29482
PNG
(Pyrazolo[1,5-a]-1,3,5-triazine, 13-7)
Show SMILES CCCCN(CCC)c1nc(C)nc2c(c(C)nn12)-c1c(C)cc(nc1C)N(C)C |(2.43,11.35,;1.94,9.89,;.43,9.59,;-.06,8.13,;-1.57,7.83,;-2.34,9.16,;-1.57,10.49,;-2.34,11.83,;-2.07,6.37,;-3.58,6.06,;-4.07,4.61,;-5.58,4.3,;-3.05,3.45,;-1.54,3.75,;-.31,2.83,;.95,3.72,;2.41,3.23,;.49,5.19,;-1.05,5.21,;-.33,1.29,;-1.66,.52,;-2.99,1.29,;-1.66,-1.02,;-.33,-1.79,;1.01,-1.02,;1.01,.52,;2.34,1.29,;-.33,-3.33,;1.01,-4.1,;-1.66,-4.1,)|
Show InChI InChI=1S/C23H35N7/c1-9-11-13-29(12-10-2)23-26-18(6)25-22-21(17(5)27-30(22)23)20-15(3)14-19(28(7)8)24-16(20)4/h14H,9-13H2,1-8H3
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n/an/a 12.8n/an/an/an/a7.223



Bristol-Myers Squibb Company



Assay Description
Naive rats were sacrificed by decapitation, and the brain and pituitary were collected. Slide-mounted brain sections were preincubated in an assay so...

J Med Chem 52: 3084-92 (2009)


Article DOI: 10.1021/jm900025h
BindingDB Entry DOI: 10.7270/Q20000D0
More data for this
Ligand-Target Pair
Corticotropin-releasing factor receptor 1


(Rattus norvegicus (rat))		BDBM29483
PNG
(Pyrazolo[1,5-a]-1,3,5-triazine, 13-8)
Show SMILES CCN(CC)c1nc(C)nc2c(c(C)nn12)-c1cnc(cc1C)N(C)C |(.43,9.59,;-.06,8.13,;-1.57,7.83,;-2.34,9.16,;-1.57,10.49,;-2.07,6.37,;-3.58,6.06,;-4.07,4.61,;-5.58,4.3,;-3.05,3.45,;-1.54,3.75,;-.31,2.83,;.95,3.72,;2.41,3.23,;.49,5.19,;-1.05,5.21,;-.33,1.29,;1.01,.52,;1.01,-1.02,;-.33,-1.79,;-1.66,-1.02,;-1.66,.52,;-2.99,1.29,;-.33,-3.33,;1.01,-4.1,;-1.66,-4.1,)|
Show InChI InChI=1S/C19H27N7/c1-8-25(9-2)19-22-14(5)21-18-17(13(4)23-26(18)19)15-11-20-16(24(6)7)10-12(15)3/h10-11H,8-9H2,1-7H3
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n/an/a 13.8n/an/an/an/a7.223



Bristol-Myers Squibb Company



Assay Description
Naive rats were sacrificed by decapitation, and the brain and pituitary were collected. Slide-mounted brain sections were preincubated in an assay so...

J Med Chem 52: 3084-92 (2009)


Article DOI: 10.1021/jm900025h
BindingDB Entry DOI: 10.7270/Q20000D0
More data for this
Ligand-Target Pair
Corticotropin-releasing factor receptor 1


(Rattus norvegicus (rat))		BDBM29487
PNG
(Pyrazolo[1,5-a]-1,3,5-triazine, 13-12)
Show SMILES CCN(CC)c1nc(C)nc2c(c(C)nn12)-c1cnc(OC)cc1C |(-2.1,10.44,;-2.59,8.98,;-1.57,7.83,;-.06,8.13,;.34,9.62,;-2.07,6.37,;-3.58,6.06,;-4.07,4.61,;-5.58,4.3,;-3.05,3.45,;-1.54,3.75,;-.31,2.83,;.95,3.72,;2.41,3.23,;.49,5.19,;-1.05,5.21,;-.33,1.29,;1.01,.52,;1.01,-1.02,;-.33,-1.79,;-.33,-3.33,;1.01,-4.1,;-1.66,-1.02,;-1.66,.52,;-2.99,1.29,)|
Show InChI InChI=1S/C18H24N6O/c1-7-23(8-2)18-21-13(5)20-17-16(12(4)22-24(17)18)14-10-19-15(25-6)9-11(14)3/h9-10H,7-8H2,1-6H3
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n/an/a 14.5n/an/an/an/a7.223



Bristol-Myers Squibb Company



Assay Description
Naive rats were sacrificed by decapitation, and the brain and pituitary were collected. Slide-mounted brain sections were preincubated in an assay so...

J Med Chem 52: 3084-92 (2009)


Article DOI: 10.1021/jm900025h
BindingDB Entry DOI: 10.7270/Q20000D0
More data for this
Ligand-Target Pair
Corticotropin-releasing factor receptor 1


(Rattus norvegicus (rat))		BDBM29480
PNG
(Pyrazolo[1,5-a]-1,3,5-triazine, 13-5)
Show SMILES CCCN(CCC)c1nc(C)nc2c(c(C)nn12)-c1c(C)cc(nc1C)N(C)C |(-2.34,11.83,;-1.57,10.49,;-2.34,9.16,;-1.57,7.83,;-.06,8.13,;.43,9.59,;1.94,9.89,;-2.07,6.37,;-3.58,6.06,;-4.07,4.61,;-5.58,4.3,;-3.05,3.45,;-1.54,3.75,;-.31,2.83,;.95,3.72,;2.41,3.23,;.49,5.19,;-1.05,5.21,;-.33,1.29,;-1.66,.52,;-2.99,1.29,;-1.66,-1.02,;-.33,-1.79,;1.01,-1.02,;1.01,.52,;2.34,1.29,;-.33,-3.33,;1.01,-4.1,;-1.66,-4.1,)|
Show InChI InChI=1S/C22H33N7/c1-9-11-28(12-10-2)22-25-17(6)24-21-20(16(5)26-29(21)22)19-14(3)13-18(27(7)8)23-15(19)4/h13H,9-12H2,1-8H3
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n/an/a 14.9n/an/an/an/a7.223



Bristol-Myers Squibb Company



Assay Description
Naive rats were sacrificed by decapitation, and the brain and pituitary were collected. Slide-mounted brain sections were preincubated in an assay so...

J Med Chem 52: 3084-92 (2009)


Article DOI: 10.1021/jm900025h
BindingDB Entry DOI: 10.7270/Q20000D0
More data for this
Ligand-Target Pair
Corticotropin-releasing factor receptor 1


(Rattus norvegicus (rat))		BDBM29502
PNG
(Pyrazolo[1,5-a]-1,3,5-triazine, 13-27)
Show SMILES CCCN(C)c1nc(C)nc2c(c(C)nn12)-c1ccc(OC)nc1C |(1.82,10.01,;.34,9.62,;-.06,8.13,;-1.57,7.83,;-2.59,8.98,;-2.07,6.37,;-3.58,6.06,;-4.07,4.61,;-5.58,4.3,;-3.05,3.45,;-1.54,3.75,;-.31,2.83,;.95,3.72,;2.41,3.23,;.49,5.19,;-1.05,5.21,;-.33,1.29,;-1.66,.52,;-1.66,-1.02,;-.33,-1.79,;-.33,-3.33,;1.01,-4.1,;1.01,-1.02,;1.01,.52,;2.34,1.29,)|
Show InChI InChI=1S/C18H24N6O/c1-7-10-23(5)18-21-13(4)20-17-16(12(3)22-24(17)18)14-8-9-15(25-6)19-11(14)2/h8-9H,7,10H2,1-6H3
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n/an/a 17.6n/an/an/an/a7.223



Bristol-Myers Squibb Company



Assay Description
Naive rats were sacrificed by decapitation, and the brain and pituitary were collected. Slide-mounted brain sections were preincubated in an assay so...

J Med Chem 52: 3084-92 (2009)


Article DOI: 10.1021/jm900025h
BindingDB Entry DOI: 10.7270/Q20000D0
More data for this
Ligand-Target Pair
Corticotropin-releasing factor receptor 1


(Rattus norvegicus (rat))		BDBM29486
PNG
(Pyrazolo[1,5-a]-1,3,5-triazine, 13-11)
Show SMILES COCCN(CCOC)c1nc(C)nc2c(c(C)nn12)-c1cnc(OC)cc1C |(-2.62,13.06,;-3.11,11.6,;-2.1,10.44,;-2.59,8.98,;-1.57,7.83,;-.06,8.13,;.34,9.62,;1.82,10.01,;2.22,11.5,;-2.07,6.37,;-3.58,6.06,;-4.07,4.61,;-5.58,4.3,;-3.05,3.45,;-1.54,3.75,;-.31,2.83,;.95,3.72,;2.41,3.23,;.49,5.19,;-1.05,5.21,;-.33,1.29,;1.01,.52,;1.01,-1.02,;-.33,-1.79,;-.33,-3.33,;1.01,-4.1,;-1.66,-1.02,;-1.66,.52,;-2.99,1.29,)|
Show InChI InChI=1S/C20H28N6O3/c1-13-11-17(29-6)21-12-16(13)18-14(2)24-26-19(18)22-15(3)23-20(26)25(7-9-27-4)8-10-28-5/h11-12H,7-10H2,1-6H3
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n/an/a 23.8n/an/an/an/a7.223



Bristol-Myers Squibb Company



Assay Description
Naive rats were sacrificed by decapitation, and the brain and pituitary were collected. Slide-mounted brain sections were preincubated in an assay so...

J Med Chem 52: 3084-92 (2009)


Article DOI: 10.1021/jm900025h
BindingDB Entry DOI: 10.7270/Q20000D0
More data for this
Ligand-Target Pair
Corticotropin-releasing factor receptor 1


(Rattus norvegicus (rat))		BDBM29485
PNG
(Pyrazolo[1,5-a]-1,3,5-triazine, 13-10)
Show SMILES CCC(CC)Nc1nc(C)nc2c(c(C)nn12)-c1cnc(cc1C)N(C)C |(1.94,9.89,;.43,9.59,;-.06,8.13,;.95,6.97,;2.44,7.37,;-1.57,7.83,;-2.07,6.37,;-3.58,6.06,;-4.07,4.61,;-5.58,4.3,;-3.05,3.45,;-1.54,3.75,;-.31,2.83,;.95,3.72,;2.41,3.23,;.49,5.19,;-1.05,5.21,;-.33,1.29,;1.01,.52,;1.01,-1.02,;-.33,-1.79,;-1.66,-1.02,;-1.66,.52,;-2.99,1.29,;-.33,-3.33,;1.01,-4.1,;-1.66,-4.1,)|
Show InChI InChI=1S/C20H29N7/c1-8-15(9-2)24-20-23-14(5)22-19-18(13(4)25-27(19)20)16-11-21-17(26(6)7)10-12(16)3/h10-11,15H,8-9H2,1-7H3,(H,22,23,24)
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n/an/a 24.8n/an/an/an/a7.223



Bristol-Myers Squibb Company



Assay Description
Naive rats were sacrificed by decapitation, and the brain and pituitary were collected. Slide-mounted brain sections were preincubated in an assay so...

J Med Chem 52: 3084-92 (2009)


Article DOI: 10.1021/jm900025h
BindingDB Entry DOI: 10.7270/Q20000D0
More data for this
Ligand-Target Pair
Corticotropin-releasing factor receptor 1


(Rattus norvegicus (rat))		BDBM29476
PNG
(Pyrazolo[1,5-a]-1,3,5-triazine, 13-1)
Show SMILES CCC(CC)Nc1nc(C)nc2c(c(C)nn12)-c1c(C)cc(nc1C)N(C)C |(1.94,9.89,;.43,9.59,;-.06,8.13,;.95,6.97,;2.44,7.37,;-1.57,7.83,;-2.07,6.37,;-3.58,6.06,;-4.07,4.61,;-5.58,4.3,;-3.05,3.45,;-1.54,3.75,;-.31,2.83,;.95,3.72,;2.41,3.23,;.49,5.19,;-1.05,5.21,;-.33,1.29,;-1.66,.52,;-2.99,1.29,;-1.66,-1.02,;-.33,-1.79,;1.01,-1.02,;1.01,.52,;2.34,1.29,;-.33,-3.33,;1.01,-4.1,;-1.66,-4.1,)|
Show InChI InChI=1S/C21H31N7/c1-9-16(10-2)25-21-24-15(6)23-20-19(14(5)26-28(20)21)18-12(3)11-17(27(7)8)22-13(18)4/h11,16H,9-10H2,1-8H3,(H,23,24,25)
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n/an/a 25.6n/an/an/an/a7.223



Bristol-Myers Squibb Company



Assay Description
Naive rats were sacrificed by decapitation, and the brain and pituitary were collected. Slide-mounted brain sections were preincubated in an assay so...

J Med Chem 52: 3084-92 (2009)


Article DOI: 10.1021/jm900025h
BindingDB Entry DOI: 10.7270/Q20000D0
More data for this
Ligand-Target Pair
Corticotropin-releasing factor receptor 1


(Rattus norvegicus (rat))		BDBM29481
PNG
(Pyrazolo[1,5-a]-1,3,5-triazine, 13-6)
Show SMILES CCCCN(CC)c1nc(C)nc2c(c(C)nn12)-c1c(C)cc(nc1C)N(C)C |(2.43,11.35,;1.94,9.89,;.43,9.59,;-.06,8.13,;-1.57,7.83,;-2.34,9.16,;-1.57,10.49,;-2.07,6.37,;-3.58,6.06,;-4.07,4.61,;-5.58,4.3,;-3.05,3.45,;-1.54,3.75,;-.31,2.83,;.95,3.72,;2.41,3.23,;.49,5.19,;-1.05,5.21,;-.33,1.29,;-1.66,.52,;-2.99,1.29,;-1.66,-1.02,;-.33,-1.79,;1.01,-1.02,;1.01,.52,;2.34,1.29,;-.33,-3.33,;1.01,-4.1,;-1.66,-4.1,)|
Show InChI InChI=1S/C22H33N7/c1-9-11-12-28(10-2)22-25-17(6)24-21-20(16(5)26-29(21)22)19-14(3)13-18(27(7)8)23-15(19)4/h13H,9-12H2,1-8H3
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n/an/a 32.8n/an/an/an/a7.223



Bristol-Myers Squibb Company



Assay Description
Naive rats were sacrificed by decapitation, and the brain and pituitary were collected. Slide-mounted brain sections were preincubated in an assay so...

J Med Chem 52: 3084-92 (2009)


Article DOI: 10.1021/jm900025h
BindingDB Entry DOI: 10.7270/Q20000D0
More data for this
Ligand-Target Pair
Corticotropin-releasing factor receptor 1


(Rattus norvegicus (rat))		BDBM29479
PNG
(Pyrazolo[1,5-a]-1,3,5-triazine, 13-4)
Show SMILES CCN(CC)c1nc(C)nc2c(c(C)nn12)-c1c(C)cc(nc1C)N(C)C |(.43,9.59,;-.06,8.13,;-1.57,7.83,;-2.34,9.16,;-1.57,10.49,;-2.07,6.37,;-3.58,6.06,;-4.07,4.61,;-5.58,4.3,;-3.05,3.45,;-1.54,3.75,;-.31,2.83,;.95,3.72,;2.41,3.23,;.49,5.19,;-1.05,5.21,;-.33,1.29,;-1.66,.52,;-2.99,1.29,;-1.66,-1.02,;-.33,-1.79,;1.01,-1.02,;1.01,.52,;2.34,1.29,;-.33,-3.33,;1.01,-4.1,;-1.66,-4.1,)|
Show InChI InChI=1S/C20H29N7/c1-9-26(10-2)20-23-15(6)22-19-18(14(5)24-27(19)20)17-12(3)11-16(25(7)8)21-13(17)4/h11H,9-10H2,1-8H3
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n/an/a 58n/an/an/an/a7.223



Bristol-Myers Squibb Company



Assay Description
Naive rats were sacrificed by decapitation, and the brain and pituitary were collected. Slide-mounted brain sections were preincubated in an assay so...

J Med Chem 52: 3084-92 (2009)


Article DOI: 10.1021/jm900025h
BindingDB Entry DOI: 10.7270/Q20000D0
More data for this
Ligand-Target Pair
Corticotropin-releasing factor receptor 1


(Rattus norvegicus (rat))		BDBM29501
PNG
(Pyrazolo[1,5-a]-1,3,5-triazine, 13-26)
Show SMILES CCN(C)c1nc(C)nc2c(c(C)nn12)-c1ccc(OC)nc1C |(.34,9.62,;-.06,8.13,;-1.57,7.83,;-2.59,8.98,;-2.07,6.37,;-3.58,6.06,;-4.07,4.61,;-5.58,4.3,;-3.05,3.45,;-1.54,3.75,;-.31,2.83,;.95,3.72,;2.41,3.23,;.49,5.19,;-1.05,5.21,;-.33,1.29,;-1.66,.52,;-1.66,-1.02,;-.33,-1.79,;-.33,-3.33,;1.01,-4.1,;1.01,-1.02,;1.01,.52,;2.34,1.29,)|
Show InChI InChI=1S/C17H22N6O/c1-7-22(5)17-20-12(4)19-16-15(11(3)21-23(16)17)13-8-9-14(24-6)18-10(13)2/h8-9H,7H2,1-6H3
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n/an/a 81.6n/an/an/an/a7.223



Bristol-Myers Squibb Company



Assay Description
Naive rats were sacrificed by decapitation, and the brain and pituitary were collected. Slide-mounted brain sections were preincubated in an assay so...

J Med Chem 52: 3084-92 (2009)


Article DOI: 10.1021/jm900025h
BindingDB Entry DOI: 10.7270/Q20000D0
More data for this
Ligand-Target Pair
Corticotropin-releasing factor receptor 1


(Rattus norvegicus (rat))		BDBM29484
PNG
(Pyrazolo[1,5-a]-1,3,5-triazine, 13-9)
Show SMILES COCCN(CCOC)c1nc(C)nc2c(c(C)nn12)-c1cnc(cc1C)N(C)C |(2.43,11.35,;1.94,9.89,;.43,9.59,;-.06,8.13,;-1.57,7.83,;-2.34,9.16,;-1.57,10.49,;-2.34,11.83,;-1.57,13.16,;-2.07,6.37,;-3.58,6.06,;-4.07,4.61,;-5.58,4.3,;-3.05,3.45,;-1.54,3.75,;-.31,2.83,;.95,3.72,;2.41,3.23,;.49,5.19,;-1.05,5.21,;-.33,1.29,;1.01,.52,;1.01,-1.02,;-.33,-1.79,;-1.66,-1.02,;-1.66,.52,;-2.99,1.29,;-.33,-3.33,;1.01,-4.1,;-1.66,-4.1,)|
Show InChI InChI=1S/C21H31N7O2/c1-14-12-18(26(4)5)22-13-17(14)19-15(2)25-28-20(19)23-16(3)24-21(28)27(8-10-29-6)9-11-30-7/h12-13H,8-11H2,1-7H3
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n/an/a 91.9n/an/an/an/a7.223



Bristol-Myers Squibb Company



Assay Description
Naive rats were sacrificed by decapitation, and the brain and pituitary were collected. Slide-mounted brain sections were preincubated in an assay so...

J Med Chem 52: 3084-92 (2009)


Article DOI: 10.1021/jm900025h
BindingDB Entry DOI: 10.7270/Q20000D0
More data for this
Ligand-Target Pair
Corticotropin-releasing factor receptor 1


(Rattus norvegicus (rat))		BDBM29478
PNG
(Pyrazolo[1,5-a]-1,3,5-triazine, 13-3)
Show SMILES COCCN(CCOC)c1nc(C)nc2c(c(C)nn12)-c1c(C)cc(nc1C)N(C)C |(2.43,11.35,;1.94,9.89,;.43,9.59,;-.06,8.13,;-1.57,7.83,;-2.34,9.16,;-1.57,10.49,;-2.34,11.83,;-1.57,13.16,;-2.07,6.37,;-3.58,6.06,;-4.07,4.61,;-5.58,4.3,;-3.05,3.45,;-1.54,3.75,;-.31,2.83,;.95,3.72,;2.41,3.23,;.49,5.19,;-1.05,5.21,;-.33,1.29,;-1.66,.52,;-2.99,1.29,;-1.66,-1.02,;-.33,-1.79,;1.01,-1.02,;1.01,.52,;2.34,1.29,;-.33,-3.33,;1.01,-4.1,;-1.66,-4.1,)|
Show InChI InChI=1S/C22H33N7O2/c1-14-13-18(27(5)6)23-15(2)19(14)20-16(3)26-29-21(20)24-17(4)25-22(29)28(9-11-30-7)10-12-31-8/h13H,9-12H2,1-8H3
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n/an/a 133n/an/an/an/a7.223



Bristol-Myers Squibb Company



Assay Description
Naive rats were sacrificed by decapitation, and the brain and pituitary were collected. Slide-mounted brain sections were preincubated in an assay so...

J Med Chem 52: 3084-92 (2009)


Article DOI: 10.1021/jm900025h
BindingDB Entry DOI: 10.7270/Q20000D0
More data for this
Ligand-Target Pair
Corticotropin-releasing factor receptor 1


(Rattus norvegicus (rat))		BDBM29477
PNG
(Pyrazolo[1,5-a]-1,3,5-triazine, 13-2)
Show SMILES COCCNc1nc(C)nc2c(c(C)nn12)-c1c(C)cc(nc1C)N(C)C |(2.43,11.35,;1.94,9.89,;.43,9.59,;-.06,8.13,;-1.57,7.83,;-2.07,6.37,;-3.58,6.06,;-4.07,4.61,;-5.58,4.3,;-3.05,3.45,;-1.54,3.75,;-.31,2.83,;.95,3.72,;2.41,3.23,;.49,5.19,;-1.05,5.21,;-.33,1.29,;-1.66,.52,;-2.99,1.29,;-1.66,-1.02,;-.33,-1.79,;1.01,-1.02,;1.01,.52,;2.34,1.29,;-.33,-3.33,;1.01,-4.1,;-1.66,-4.1,)|
Show InChI InChI=1S/C19H27N7O/c1-11-10-15(25(5)6)21-12(2)16(11)17-13(3)24-26-18(17)22-14(4)23-19(26)20-8-9-27-7/h10H,8-9H2,1-7H3,(H,20,22,23)
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n/an/a>1.00E+4n/an/an/an/a7.223



Bristol-Myers Squibb Company



Assay Description
Naive rats were sacrificed by decapitation, and the brain and pituitary were collected. Slide-mounted brain sections were preincubated in an assay so...

J Med Chem 52: 3084-92 (2009)


Article DOI: 10.1021/jm900025h
BindingDB Entry DOI: 10.7270/Q20000D0
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%