CFam Chemical Families Database
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You are searching for "CFAMM00386487" 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 CFAMM00386487
Family CFFBM8242 Integrin beta-1 and Integrin alpha-4 inhibitor AGN-PC-02YIN5 family
Superfamily CFSBM4455 D(2) dopamine receptor and Integrin beta-1 Binder Superfamily
Class CFCID1057 Class 2407
External ID CHEMBL361914 External Source CHEMBL
PubChem CID 44392358 Functional Category Bioactive
Molecule Name AGN-PC-075E7V
IUPAC Name 2-[4-[1-[2-[3-methoxy-4-[(2-methylphenyl)carbamoylamino]phenyl]acetyl]-2,5-dihydropyrrole-2-carbonyl]piperazin-1-yl]acetic acid
Synonyms CHEBI:405473;2-[4-[1-[2-[3-methoxy-4-[(2-methylphenyl)carbamoylamino]phenyl]acetyl]-2,5-dihydropyrrole-2-carbonyl]piperazin-1-yl]acetic acid
InChi InChI=1S/C28H33N5O6/c1-19-6-3-4-7-21(19)29-28(38)30-22-10-9-20(16-24(22)39-2)17-25(34)33-11-5-8-23(33)27(37)32-14-12-31(13-15-32)18-26(35)36/h3-10,16,23H,11-15,17-18H2,1-2H3,(H,35,36)(H2,29,30,38)
InChiKey CBKWFBALGVYSLI-UHFFFAOYSA-N
Formula C28H33N5O6 Molecular Weight 535.59
Cross Link CHEMBL361914
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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