CFam Chemical Families Database
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You are searching for "CFAMM00187599" in compound.

Total 1 results found.

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 CFAMM00187599
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 53968802 External Source PubChem
PubChem CID 53968802 Functional Category Patent Compound
Molecule Name AGN-PC-02IREC
IUPAC Name N-[4-[4,4-difluoro-5-[2-(2-methoxyethylamino)-2-oxoethylidene]-2,3-dihydro-1-benzazepine-1-carbonyl]phenyl]-2-phenylbenzamide
Synonyms SureCN8672309;N-[4-[(5E)-4,4-difluoro-5-[2-(2-methoxyethylamino)-2-oxoethylidene]-2,3-dihydro-1-benzazepine-1-carbonyl]phenyl]-2-phenylbenzamide
InChi InChI=1S/C35H31F2N3O4/c1-44-22-20-38-32(41)23-30-29-13-7-8-14-31(29)40(21-19-35(30,36)37)34(43)25-15-17-26(18-16-25)39-33(42)28-12-6-5-11-27(28)24-9-3-2-4-10-24/h2-18,23H,19-22H2,1H3,(H,38,41)(H,39,42)
InChiKey JQDWCCUKSABFGI-UHFFFAOYSA-N
Formula C35H31F2N3O4 Molecular Weight 595.64
Cross Link
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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