CFam Chemical Families Database
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You are searching for "CFAMM00313714" in compound.

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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 CFAMM00313714
Family CFFBM609 Histamine H3 receptor and Potassium voltage-gated channel subfamily H member 2 ligand SureCN3456167 family
Superfamily CFSBM76 cAMP and Prelamin-A/C Binder Superfamily
Class CFCBM33 Class 3083
External ID CHEMBL513967 External Source CHEMBL
PubChem CID 44589204 Functional Category Bioactive
Molecule Name 3-methyl-4-[4-[3-(1,3-thiazol-2-yl)pyrazol-1-yl]-2,3-dihydropyrrolo[2,3-b]pyridin-1-yl]benzonitrile
IUPAC Name 3-methyl-4-[4-[3-(1,3-thiazol-2-yl)pyrazol-1-yl]-2,3-dihydropyrrolo[2,3-b]pyridin-1-yl]benzonitrile
Synonyms AGN-PC-077RHQ;3-methyl-4-[4-[3-(1,3-thiazol-2-yl)pyrazol-1-yl]-2,3-dihydropyrrolo[2,3-b]pyridin-1-yl]benzonitrile
InChi InChI=1S/C21H16N6S/c1-14-12-15(13-22)2-3-18(14)26-9-5-16-19(4-7-23-20(16)26)27-10-6-17(25-27)21-24-8-11-28-21/h2-4,6-8,10-12H,5,9H2,1H3
InChiKey FLMLJCQCCSHCLT-UHFFFAOYSA-N
Formula C21H16N6S Molecular Weight 384.46
Cross Link CHEMBL513967
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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