CFam Chemical Families Database
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You are searching for "CFAMM00394633" in compound.

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CFAM Mol ID CFAMM00394633
Family CFFBM9345 MAP kinase-activated protein kinase 2 inhibitor N-[4-(4-oxospiro[5,6-dihydro-1H-pyrrolo[3,2-c]pyridine-7,4'-piperidine]-2-yl)pyridin-2-yl]-3-(trifluoromethoxy)benzamide family
Superfamily CFSBM4808 P2X purinoceptor 3 and Cytochrome P450 3A4 Binder Superfamily
Class CFCCD257 Class 1070
External ID CHEMBL1933192 External Source CHEMBL
PubChem CID 57398710 Functional Category Bioactive
Molecule Name N-[4-(4-oxospiro[5,6-dihydro-1H-pyrrolo[3,2-c]pyridine-7,3'-pyrrolidine]-2-yl)pyridin-2-yl]-3-(trifluoromethoxy)benzamide
IUPAC Name N-[4-(4-oxospiro[5,6-dihydro-1H-pyrrolo[3,2-c]pyridine-7,3'-pyrrolidine]-2-yl)pyridin-2-yl]-3-(trifluoromethoxy)benzamide
Synonyms AGN-PC-0BTM91;SureCN12543798;N-[4-(4-oxospiro[5,6-dihydro-1H-pyrrolo[3,2-c]pyridine-7,3'-pyrrolidine]-2-yl)pyridin-2-yl]-3-(trifluoromethoxy)benzamide
InChi InChI=1S/C23H20F3N5O3/c24-23(25,26)34-15-3-1-2-14(8-15)20(32)31-18-9-13(4-6-28-18)17-10-16-19(30-17)22(5-7-27-11-22)12-29-21(16)33/h1-4,6,8-10,27,30H,5,7,11-12H2,(H,29,33)(H,28,31,32)
InChiKey FTVRHNVXLBYVGQ-UHFFFAOYSA-N
Formula C23H20F3N5O3 Molecular Weight 471.43
Cross Link CHEMBL1933192
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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