CFam Chemical Families Database
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You are searching for "CFAMM00328870" in compound.

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CFAM Mol ID CFAMM00328870
Family CFFBM1923 Collagenase 3 inhibitor N-[[3-[5-[[(1R)-1-cyclohexyl-2-(methylamino)-2-oxoethyl]carbamoyl]furan-2-yl]phenyl]methyl]-6-(trifluoromethyl)pyridine-2-carboxamide family
Superfamily CFSCD123 Cathepsin K and Neuronal acetylcholine receptor subunit alpha-4 Binder Superfamily
Class CFCCD105 Class 918
External ID CHEMBL1223490 External Source CHEMBL
PubChem CID 46207292 Functional Category Bioactive
Molecule Name SureCN1316861
IUPAC Name N-[[3-[5-[[(1S)-2-(methylamino)-1-(oxan-4-yl)-2-oxoethyl]carbamoyl]furan-2-yl]phenyl]methyl]-6-(trifluoromethyl)pyridine-2-carboxamide
Synonyms CHEBI:789937
InChi InChI=1S/C27H27F3N4O5/c1-31-26(37)23(17-10-12-38-13-11-17)34-25(36)21-9-8-20(39-21)18-5-2-4-16(14-18)15-32-24(35)19-6-3-7-22(33-19)27(28,29)30/h2-9,14,17,23H,10-13,15H2,1H3,(H,31,37)(H,32,35)(H,34,36)/t23-/m0/s1
InChiKey BAKKSMNSYICTIW-QHCPKHFHSA-N
Formula C27H27F3N4O5 Molecular Weight 544.52
Cross Link CHEMBL1223490
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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