CFam Chemical Families Database
BIDD Pharmainformatics Databases
 
   
You are searching for "CFAMM00453579" 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 CFAMM00453579
Family CFFBM19898 Integrin beta-3 and Integrin alpha-IIb inhibitor 4-[[4-(4-carbamimidoylphenyl)-1,3-thiazol-2-yl]-[1-(carboxymethyl)piperidin-4-yl]amino]butanoic acid family
Superfamily CFSID426 Aldose reductase Inhibitor SPR-210 Superfamily
Class CFCID297 Class 1647
External ID CHEMBL114589 External Source CHEMBL
PubChem CID 9867414 Functional Category Bioactive
Molecule Name SureCN3497287
IUPAC Name 3-[[4-(4-carbamimidoylphenyl)-1,3-thiazol-2-yl]-[1-(carboxymethyl)piperidin-4-yl]amino]propanoic acid
Synonyms CHEBI:288333;3-{[4-(4-AMIDINOPHENYL)THIAZOL-2-YL][1-(CARBOXYMETHYL)-PIPERIDIN-4-YL]AMINO}PROPANOIC ACID
InChi InChI=1S/C20H25N5O4S/c21-19(22)14-3-1-13(2-4-14)16-12-30-20(23-16)25(10-7-17(26)27)15-5-8-24(9-6-15)11-18(28)29/h1-4,12,15H,5-11H2,(H3,21,22)(H,26,27)(H,28,29)
InChiKey LYIQNVKSTSEEEG-UHFFFAOYSA-N
Formula C20H25N5O4S Molecular Weight 431.51
Cross Link CHEMBL114589
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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