CFam Chemical Families Database
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You are searching for "CFAMM00381534" 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 CFAMM00381534
Family CFFBM7595 Coagulation factor X and Cationic trypsin inhibitor AGN-PC-0759GY family
Superfamily CFSBM1174 Cruzipain and Cationic trypsin Binder Superfamily
Class CFCAD667 Class 667
External ID CHEMBL459215 External Source CHEMBL
PubChem CID 44593424 Functional Category Bioactive
Molecule Name SureCN3275214
IUPAC Name 6-[[4-[2-(4-tert-butylphenyl)-1H-benzimidazol-4-yl]piperazin-1-yl]methyl]-1,4-dihydroquinoxaline-2,3-dione
Synonyms CHEBI:549644
InChi InChI=1S/C30H32N6O2/c1-30(2,3)21-10-8-20(9-11-21)27-31-23-5-4-6-25(26(23)34-27)36-15-13-35(14-16-36)18-19-7-12-22-24(17-19)33-29(38)28(37)32-22/h4-12,17H,13-16,18H2,1-3H3,(H,31,34)(H,32,37)(H,33,38)
InChiKey IFRHRAPSJRMCTF-UHFFFAOYSA-N
Formula C30H32N6O2 Molecular Weight 508.61
Cross Link CHEMBL459215
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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