Binder Information
| Binder General Information | Top | |||
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| Binder ID |
BC3LA5
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| Binder Name |
2-[4-[1-[(4-Aminocyclohexyl)amino]ethyl]phenyl]-7-[(2R)-butan-2-yl]oxy-1-(4-chlorophenyl)-6-methoxy-1,4-dihydroisoquinolin-3-one
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| Synonyms |
SCHEMBL2388431; SCHEMBL2388436; SCHEMBL2391273; CHEMBL3683150; SCHEMBL12258359; BDBM161959; US9051279, 66
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| Binder Type |
Small molecular drug
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| Structure |
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Download2D MOL |
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| Formula |
C34H42ClN3O3
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| Canonical SMILES |
CC[C@@H](C)OC1=C(C=C2CC(=O)N(C(C2=C1)C3=CC=C(C=C3)Cl)C4=CC=C(C=C4)C(C)NC5CCC(CC5)N)OC
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| InChI |
1S/C34H42ClN3O3/c1-5-21(2)41-32-20-30-25(18-31(32)40-4)19-33(39)38(34(30)24-6-10-26(35)11-7-24)29-16-8-23(9-17-29)22(3)37-28-14-12-27(36)13-15-28/h6-11,16-18,20-22,27-28,34,37H,5,12-15,19,36H2,1-4H3/t21-,22?,27?,28?,34?/m1/s1
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| InChIKey |
WDKPXBMAYNJPHO-OBZRKWEBSA-N
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| PubChem Compound ID | ||||
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