CFam Chemical Families Database
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You are searching for "CFAMM00125478" in compound.

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CFAM Mol ID CFAMM00125478
Family CFFAD1088 Receptor-type tyrosine-protein kinase FLT3 and Mast/stem cell growth factor receptor Kit Ligand Ponatinib Family
Superfamily CFSAD913 Receptor-type tyrosine-protein kinase FLT3 and Mast/stem cell growth factor receptor Kit Ligand Ponatinib Superfamily
Class CFCAD794 Class 794
External ID CHEMBL265956 External Source CHEMBL
PubChem CID 44450064 Functional Category Bioactive
Molecule Name 5-methyl-4-[2-methyl-5-[[3-(trifluoromethyl)benzoyl]amino]anilino]-N-[(1S)-1-phenylethyl]pyrrolo[2,1-f][1,2,4]triazine-6-carboxamide
IUPAC Name 5-methyl-4-[2-methyl-5-[[3-(trifluoromethyl)benzoyl]amino]anilino]-N-[(1S)-1-phenylethyl]pyrrolo[2,1-f][1,2,4]triazine-6-carboxamide
Synonyms SureCN12729258
InChi InChI=1S/C31H27F3N6O2/c1-18-12-13-24(38-29(41)22-10-7-11-23(14-22)31(32,33)34)15-26(18)39-28-27-19(2)25(16-40(27)36-17-35-28)30(42)37-20(3)21-8-5-4-6-9-21/h4-17,20H,1-3H3,(H,37,42)(H,38,41)(H,35,36,39)/t20-/m0/s1
InChiKey SIKBEHOEFUOLBV-FQEVSTJZSA-N
Formula C31H27F3N6O2 Molecular Weight 572.58
Cross Link CHEMBL265956
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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Deputy Director of Center for Computational Science and Engineering
Professor in Department of Pharmacy
National University of Singapore, Singapore


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