CFam Chemical Families Database
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You are searching for "CFAMM00313457" in compound.

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Click on CFAM IDs and names to search or view in CFAM, click on external IDs to view the entity in its source database.

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CFAM Mol ID CFAMM00313457
Family CFFBM588 Vasopressin V1a receptor and Vasopressin V2 receptor ligand (3-methoxy-4-quinolin-8-ylphenyl)-[(1R,5S)-3,3,5-trimethyl-7-azabicyclo[3.2.1]octan-7-yl]methanone family
Superfamily CFSBM308 Vasopressin V2 receptor and Vasopressin V1a receptor Binder Superfamily 2
Class CFCBM120 Class 3170
External ID CHEMBL309872 External Source CHEMBL
PubChem CID 44461266 Functional Category Bioactive
Molecule Name 1-[2-[4-(6-chloro-1H-indol-3-yl)-3,6-dihydro-2H-pyridin-1-yl]ethyl]-3,4-dihydro-1H-isochromene-6-carboxamide
IUPAC Name 1-[2-[4-(6-chloro-1H-indol-3-yl)-3,6-dihydro-2H-pyridin-1-yl]ethyl]-3,4-dihydro-1H-isochromene-6-carboxamide
Synonyms CHEBI:231023
InChi InChI=1S/C25H26ClN3O2/c26-19-2-4-21-22(15-28-23(21)14-19)16-5-9-29(10-6-16)11-7-24-20-3-1-18(25(27)30)13-17(20)8-12-31-24/h1-5,13-15,24,28H,6-12H2,(H2,27,30)
InChiKey BGSCMPXCMQXFNP-UHFFFAOYSA-N
Formula C25H26ClN3O2 Molecular Weight 435.95
Cross Link CHEMBL309872
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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