CFam Chemical Families Database
BIDD Pharmainformatics Databases
 
   
You are searching for "CFAMM00453005" 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 CFAMM00453005
Family CFFBM19759 Dihydroorotate dehydrogenase (quinone), mitochondrial inhibitor SureCN11983337 family
Superfamily CFSBM7676 Niemann-Pick C1 protein and Ras-related protein Rab-9A Binder Superfamily 13
Class CFCCD85 Class 898
External ID CHEMBL1084928 External Source CHEMBL
PubChem CID 44631844 Functional Category Bioactive
Molecule Name SureCN11983337
IUPAC Name 2-(cyclopropanecarbonylamino)-5-[methyl(pyridin-3-ylmethyl)amino]benzoic acid
Synonyms AGN-PC-07834R;CHEBI:716099;2-(cyclopropanecarbonylamino)-5-[methyl(pyridin-3-ylmethyl)amino]benzoic acid;1X5
InChi InChI=1S/C18H19N3O3/c1-21(11-12-3-2-8-19-10-12)14-6-7-16(15(9-14)18(23)24)20-17(22)13-4-5-13/h2-3,6-10,13H,4-5,11H2,1H3,(H,20,22)(H,23,24)
InChiKey XLLCMCCHDIWDPC-UHFFFAOYSA-N
Formula C18H19N3O3 Molecular Weight 325.36
Cross Link CHEMBL1084928
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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