CFam Chemical Families Database
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You are searching for "CFAMM00312407" in compound.

Total 1 results found.

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CFAM Mol ID CFAMM00312407
Family CFFBM504 Vasopressin V1a receptor and Vasopressin V2 receptor ligand [4-(2-chloropyridin-3-yl)-3-methoxyphenyl]-[(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 CHEMBL1082493 External Source CHEMBL
PubChem CID 46890055 Functional Category Bioactive
Molecule Name [4-(2-chloropyridin-3-yl)-3-methoxyphenyl]-[(1R,5S)-3,3,5-trimethyl-7-azabicyclo[3.2.1]octan-7-yl]methanone
IUPAC Name [4-(2-chloropyridin-3-yl)-3-methoxyphenyl]-[(1R,5S)-3,3,5-trimethyl-7-azabicyclo[3.2.1]octan-7-yl]methanone
Synonyms CHEBI:731524
InChi InChI=1S/C23H27ClN2O2/c1-22(2)11-16-12-23(3,13-22)14-26(16)21(27)15-7-8-17(19(10-15)28-4)18-6-5-9-25-20(18)24/h5-10,16H,11-14H2,1-4H3/t16-,23-/m1/s1
InChiKey NQOFFOPZIDPXDH-WAIKUNEKSA-N
Formula C23H27ClN2O2 Molecular Weight 398.93
Cross Link CHEMBL1082493
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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