CFam Chemical Families Database
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You are searching for "CFAMM00306443" in compound.

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CFAM Mol ID CFAMM00306443
Family CFFBM57 Mitogen-activated protein kinase 13 and Mitogen-activated protein kinase 12 inhibitor 1-(5-tert-butyl-2-phenylpyrazol-3-yl)-3-(2,3-dihydro-1H-inden-1-yl)urea family
Superfamily CFSBM41 Mitogen-activated protein kinase 13 and Mitogen-activated protein kinase 12 Binder Superfamily
Class CFCBM14 Class 3064
External ID CHEMBL1270855 External Source CHEMBL
PubChem CID 52940949 Functional Category Bioactive
Molecule Name AGN-PC-09M45C
IUPAC Name 3-[3-tert-butyl-5-(naphthalen-1-ylcarbamoylamino)pyrazol-1-yl]-N-[2-[[2-(methylamino)-2-oxoethyl]amino]-2-oxoethyl]benzamide
Synonyms CHEBI:810102;3-[3-tert-butyl-5-(naphthalen-1-ylcarbamoylamino)pyrazol-1-yl]-N-[2-[[2-(methylamino)-2-oxoethyl]amino]-2-oxoethyl]benzamide
InChi InChI=1S/C30H33N7O4/c1-30(2,3)24-16-25(35-29(41)34-23-14-8-10-19-9-5-6-13-22(19)23)37(36-24)21-12-7-11-20(15-21)28(40)33-18-27(39)32-17-26(38)31-4/h5-16H,17-18H2,1-4H3,(H,31,38)(H,32,39)(H,33,40)(H2,34,35,41)
InChiKey FHFCWFLIOALXPQ-UHFFFAOYSA-N
Formula C30H33N7O4 Molecular Weight 555.63
Cross Link CHEMBL1270855
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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