CFam Chemical Families Database
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You are searching for "CFAMM00270706" 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 CFAMM00270706
Family CFFID2557 Mitogen-activated protein kinase kinase kinase 8 and Stromelysin-1 Inhibitor 8-chloro-quinoline-3-carbonitrile Family
Superfamily CFSID1844 Mitogen-activated protein kinase kinase kinase 8 and Stromelysin-1 Inhibitor 8-chloro-quinoline-3-carbonitrile Superfamily
Class CFCID1142 Class 2492
External ID DNC008527 External Source TTD
PubChem CID 17759555 Functional Category Investigative Drug
Molecule Name 8-chloro-quinoline-3-carbonitrile
IUPAC Name 8-chloro-4-(3-chloro-4-fluoroanilino)-6-(1H-imidazol-5-ylmethylamino)quinoline-3-carbonitrile
Synonyms AGN-PC-01LXJH;SureCN6071997;CHEMBL436817;8-chloro-quinoline-3-carbonitrile;CHEBI:488445;DNC008527;BRD-K00088062-001-01-3;8-chloro-4-(3-chloro-4-fluoroanilino)-6-(1H-imidazol-5-ylmethylamino)quinoline-3-carbonitrile
InChi InChI=1S/C20H13Cl2FN6/c21-16-4-12(1-2-18(16)23)29-19-11(6-24)7-27-20-15(19)3-13(5-17(20)22)26-9-14-8-25-10-28-14/h1-5,7-8,10,26H,9H2,(H,25,28)(H,27,29)
InChiKey ONXROKMQGCSOMG-UHFFFAOYSA-N
Formula C20H13Cl2FN6 Molecular Weight 427.26
Cross Link CHEMBL436817
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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