CFam Chemical Families Database
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You are searching for "CFAMM00328068" in compound.

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CFAM Mol ID CFAMM00328068
Family CFFBM1843 Prothrombin and Cationic trypsin inhibitor (2S)-N-[(6-aminopyridin-3-yl)methyl]-1-[(2R)-2-(benzylsulfonylamino)-3-(3,4-dichlorophenyl)propanoyl]pyrrolidine-2-carboxamide family
Superfamily CFSBM1053 Prothrombin and Coagulation factor X Binder Superfamily 4
Class CFCCD100 Class 913
External ID CHEMBL230134 External Source CHEMBL
PubChem CID 44426237 Functional Category Bioactive
Molecule Name (2R)-N-[(2S)-1-[[2-(aminomethyl)-5-chlorophenyl]methylamino]-1-oxopropan-2-yl]-2-(benzylsulfonylamino)-4-pyridin-2-ylbutanamide
IUPAC Name (2R)-N-[(2S)-1-[[2-(aminomethyl)-5-chlorophenyl]methylamino]-1-oxopropan-2-yl]-2-(benzylsulfonylamino)-4-pyridin-2-ylbutanamide
Synonyms CHEBI:484863
InChi InChI=1S/C27H32ClN5O4S/c1-19(26(34)31-17-22-15-23(28)11-10-21(22)16-29)32-27(35)25(13-12-24-9-5-6-14-30-24)33-38(36,37)18-20-7-3-2-4-8-20/h2-11,14-15,19,25,33H,12-13,16-18,29H2,1H3,(H,31,34)(H,32,35)/t19-,25+/m0/s1
InChiKey KZNJHGCVFBGYGX-UQBPGWFLSA-N
Formula C27H32ClN5O4S Molecular Weight 558.09
Cross Link CHEMBL230134
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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