CFam Chemical Families Database
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You are searching for "CFAMM00221545" 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 CFAMM00221545
Family CFFID897 Thymidylate synthase Inhibitor Sp-876 Family
Superfamily CFSID734 Thymidylate synthase Inhibitor Sp-876 Superfamily
Class CFCID516 Class 1866
External ID CHEMBL347306 External Source CHEMBL
PubChem CID 44368266 Functional Category Bioactive
Molecule Name AGN-PC-073RWL
IUPAC Name 2-[(4-sulfamoylbenzoyl)amino]pentanedioic acid
Synonyms (2S)-2-[(4-sulfamoylbenzoyl)amino]pentanedioic acid
InChi InChI=1S/C12H14N2O7S/c13-22(20,21)8-3-1-7(2-4-8)11(17)14-9(12(18)19)5-6-10(15)16/h1-4,9H,5-6H2,(H,14,17)(H,15,16)(H,18,19)(H2,13,20,21)
InChiKey QZEVTOIQUDQNAS-UHFFFAOYSA-N
Formula C12H14N2O7S Molecular Weight 330.31
Cross Link CHEMBL347306
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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