CFam Chemical Families Database
BIDD Pharmainformatics Databases
 
   
You are searching for "CFAMM00187597" 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 CFAMM00187597
Family CFFID325 Vasopressin V2 receptor Ligand FR161282 Family
Superfamily CFSID264 Vasopressin V2 receptor and Telomerase reverse transcriptase Binder Superfamily
Class CFCAD252 Class 252
External ID CHEMBL1762291 External Source CHEMBL
PubChem CID 54587372 Functional Category Bioactive
Molecule Name AGN-PC-0A9UQP
IUPAC Name N-(4-tert-butylphenyl)-4-[4-(dimethylamino)benzoyl]-1,4-diazepane-1-carboxamide
Synonyms SureCN10253366;CHEBI:1239582;N-(4-tert-butylphenyl)-4-[4-(dimethylamino)benzoyl]-1,4-diazepane-1-carboxamide
InChi InChI=1S/C25H34N4O2/c1-25(2,3)20-9-11-21(12-10-20)26-24(31)29-16-6-15-28(17-18-29)23(30)19-7-13-22(14-8-19)27(4)5/h7-14H,6,15-18H2,1-5H3,(H,26,31)
InChiKey VMCSEFNEMZGBGH-UHFFFAOYSA-N
Formula C25H34N4O2 Molecular Weight 422.56
Cross Link CHEMBL1762291
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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