CFam Chemical Families Database
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You are searching for "CFAMM00317749" 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 CFAMM00317749
Family CFFBM946 Serine/threonine-protein kinase PLK1 and Serine/threonine-protein kinase PLK3 inhibitor SureCN3503601 family
Superfamily CFSBM192 Renin and Insulin-like growth factor 1 receptor Binder Superfamily
Class CFCCD257 Class 1070
External ID CHEMBL1793891 External Source CHEMBL
PubChem CID 56668250 Functional Category Bioactive
Molecule Name AGN-PC-0BFOD1
IUPAC Name 8-[5-(4-methylpiperazin-1-yl)-2-(trifluoromethoxy)anilino]-4,5-dihydro-2H-pyrazolo[4,3-h]quinazoline-3-carboxamide
Synonyms SureCN3503609;8-[5-(4-methylpiperazin-1-yl)-2-(trifluoromethoxy)anilino]-4,5-dihydro-2H-pyrazolo[4,3-h]quinazoline-3-carboxamide
InChi InChI=1S/C22H23F3N8O2/c1-32-6-8-33(9-7-32)13-3-5-16(35-22(23,24)25)15(10-13)28-21-27-11-12-2-4-14-18(17(12)29-21)30-31-19(14)20(26)34/h3,5,10-11H,2,4,6-9H2,1H3,(H2,26,34)(H,30,31)(H,27,28,29)
InChiKey LEBAFGAECYWBLA-UHFFFAOYSA-N
Formula C22H23F3N8O2 Molecular Weight 488.47
Cross Link CHEMBL1793891
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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