CFam Chemical Families Database
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You are searching for "CFAMM00339436" 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 CFAMM00339436
Family CFFBM2930 Cellular tumor antigen p53 and DNA polymerase beta inhibitor CHEMBL1314318 family
Superfamily CFSBM1635 Cellular tumor antigen p53 and Kappa-type opioid receptor Binder Superfamily
Class CFCBM635 Class 3685
External ID CHEMBL403428 External Source CHEMBL
PubChem CID 44446216 Functional Category Bioactive
Molecule Name (2S)-3-[4-[4-(2-methoxyphenyl)piperazin-1-yl]phenyl]-2-[[(2S)-1-(4-methylphenyl)sulfonylpyrrolidine-2-carbonyl]amino]propanoic acid
IUPAC Name (2S)-3-[4-[4-(2-methoxyphenyl)piperazin-1-yl]phenyl]-2-[[(2S)-1-(4-methylphenyl)sulfonylpyrrolidine-2-carbonyl]amino]propanoic acid
Synonyms CHEBI:522056
InChi InChI=1S/C32H38N4O6S/c1-23-9-15-26(16-10-23)43(40,41)36-17-5-7-29(36)31(37)33-27(32(38)39)22-24-11-13-25(14-12-24)34-18-20-35(21-19-34)28-6-3-4-8-30(28)42-2/h3-4,6,8-16,27,29H,5,7,17-22H2,1-2H3,(H,33,37)(H,38,39)/t27-,29-/m0/s1
InChiKey CFXNSLXHWYNOJM-YTMVLYRLSA-N
Formula C32H38N4O6S Molecular Weight 606.73
Cross Link CHEMBL403428
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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