CFam Chemical Families Database
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You are searching for "CFAMM00262113" in compound.

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CFAM Mol ID CFAMM00262113
Family CFFID2191 Cathepsin G and Chymase Inhibitor JNJ-10311795 Family
Superfamily CFSID1620 Cathepsin G and Chymase Inhibitor JNJ-10311795 Superfamily
Class CFCID1032 Class 2382
External ID CHEMBL163736 External Source CHEMBL
PubChem CID 44378491 Functional Category Bioactive
Molecule Name AGN-PC-0755MF
IUPAC Name [2-[3-[[2-(2,2-diphenylethylamino)-2-oxoethyl]-methylcarbamoyl]naphthalen-2-yl]-1-naphthalen-1-yl-2-oxoethyl]phosphonic acid
Synonyms CHEBI:375941;[2-[3-[[2-(2,2-diphenylethylamino)-2-oxoethyl]-methylcarbamoyl]naphthalen-2-yl]-1-naphthalen-1-yl-2-oxoethyl]phosphonic acid
InChi InChI=1S/C40H35N2O6P/c1-42(26-37(43)41-25-36(28-13-4-2-5-14-28)29-15-6-3-7-16-29)40(45)35-24-31-19-9-8-18-30(31)23-34(35)38(44)39(49(46,47)48)33-22-12-20-27-17-10-11-21-32(27)33/h2-24,36,39H,25-26H2,1H3,(H,41,43)(H2,46,47,48)
InChiKey QGEKWHBUGJDNRH-UHFFFAOYSA-N
Formula C40H35N2O6P Molecular Weight 670.69
Cross Link CHEMBL163736
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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