CFam Chemical Families Database
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You are searching for "CFAMM00435335" in compound.

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CFAM Mol ID CFAMM00435335
Family CFFBM15646 Pol polyprotein inhibitor Enantiomer of AG1284 family
Superfamily CFSBM6665 Pol polyprotein Binder Superfamily 45
Class CFCBM2081 Class 5131
External ID CHEMBL97487 External Source CHEMBL
PubChem CID 461074 Functional Category Bioactive
Molecule Name Tertiary Amide deriv. 49
IUPAC Name N-(3,4-dihydroxybutyl)-2-[4-[2-[(1-ethylcyclopentyl)-(2-hydroxyethyl)carbamoyl]phenyl]-2-hydroxybutyl]-5-methyl-N-(2-phenylpropan-2-yl)benzamide
Synonyms AC1LA3K0;1-[2-[N-(alpha.,.alpha.-Dimethylbenzyl)-N-(3,4-dihydroxybutyl)carbamoyl]-4-methylphenyl]-4-[2-[N-(1-ethylcyclopentyl)-N-(2-hydroxyethyl)carboxamido]phenyl]-2-butanol;N-(3,4-dihydroxybutyl)-2-[4-[2-[(1-ethylcyclopentyl)-(2-hydroxyethyl)carbamoyl]phenyl]-2-hydroxybutyl]-5-methyl-N-(2-phenylpropan-2-yl)benzamide
InChi InChI=1S/C41H56N2O6/c1-5-41(22-11-12-23-41)43(25-26-44)38(48)36-16-10-9-13-31(36)19-20-34(46)28-32-18-17-30(2)27-37(32)39(49)42(24-21-35(47)29-45)40(3,4)33-14-7-6-8-15-33/h6-10,13-18,27,34-35,44-47H,5,11-12,19-26,28-29H2,1-4H3
InChiKey FTSVRSRPVCKWHD-UHFFFAOYSA-N
Formula C41H56N2O6 Molecular Weight 672.89
Cross Link CHEMBL97487
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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