CFam Chemical Families Database
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You are searching for "CFAMM00382002" in compound.

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CFAM Mol ID CFAMM00382002
Family CFFBM7656 D(1A) dopamine receptor ligand (5R)-8-bromo-3-methyl-5-phenyl-1,2,4,5-tetrahydro-3-benzazepin-7-ol;hydrochloride family
Superfamily CFSBM104 D(1A) dopamine receptor and D(2) dopamine receptor Binder Superfamily
Class CFCID882 Class 2232
External ID CHEMBL544114 External Source CHEMBL
PubChem CID 45261538 Functional Category Bioactive
Molecule Name AGN-PC-00IQQW
IUPAC Name 9-bromo-5-phenyl-3-prop-2-enyl-1,2,4,5-tetrahydro-3-benzazepine-7,8-diol;hydrobromide
Synonyms (5R)-9-bromo-5-phenyl-3-prop-2-enyl-1,2,4,5-tetrahydro-3-benzazepine-7,8-diol;hydrobromide
InChi InChI=1S/C19H20BrNO2.BrH/c1-2-9-21-10-8-14-15(11-17(22)19(23)18(14)20)16(12-21)13-6-4-3-5-7-13;/h2-7,11,16,22-23H,1,8-10,12H2;1H
InChiKey CTAUBYSSTAODOD-UHFFFAOYSA-N
Formula C19H21Br2NO2 Molecular Weight 455.18
Cross Link CHEMBL544114
Structure

Statistics of CFAM Database

 
CFAM currently contains 490,279 molecules in 87,136 families, 34,880 superfamilies and 11,643 classes.
 

How to cite our database

 
C. Zhang, L. Tao, C. Qin, P. Zhang, S.Y. Chen, X. Zeng, F. Xu, Z. Chen, S.Y. Yang and Y.Z. CFam: A Chemical Families Database Based on Iterative Selection of Functional Seeds and Seed-Directed Compound Clustering. Nucl. Acids Res. 43 (D1): D558-D565 (2015) (First published online: November 20, 2014).
 

Last update by

 
2014.08.29
 

 

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Dr. Chen Yuzong

Deputy Director of Center for Computational Science and Engineering
Professor in Department of Pharmacy
National University of Singapore, Singapore


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