CFam Chemical Families Database
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You are searching for "CFAMM00441687" in compound.

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CFAM Mol ID CFAMM00441687
Family CFFBM17296 Melanocortin receptor 4 ligand 2-amino-N-[(2R)-3-(2,4-dichlorophenyl)-1-[4-[2-[(1R)-1-hydroxy-3-methylbutyl]phenyl]piperazin-1-yl]-1-oxopropan-2-yl]acetamide family
Superfamily CFSBM6021 Melanocortin receptor 4 and C-C chemokine receptor type 1 Binder Superfamily
Class CFCAD703 Class 703
External ID CHEMBL462010 External Source CHEMBL
PubChem CID 44562367 Functional Category Bioactive
Molecule Name tert-butyl N-[(2R)-3-(2,4-dichlorophenyl)-1-[4-[2-(3-hydroxypentan-3-yl)phenyl]piperazin-1-yl]-1-oxopropan-2-yl]carbamate
IUPAC Name tert-butyl N-[(2R)-3-(2,4-dichlorophenyl)-1-[4-[2-(3-hydroxypentan-3-yl)phenyl]piperazin-1-yl]-1-oxopropan-2-yl]carbamate
Synonyms CHEBI:551448
InChi InChI=1S/C29H39Cl2N3O4/c1-6-29(37,7-2)22-10-8-9-11-25(22)33-14-16-34(17-15-33)26(35)24(32-27(36)38-28(3,4)5)18-20-12-13-21(30)19-23(20)31/h8-13,19,24,37H,6-7,14-18H2,1-5H3,(H,32,36)/t24-/m1/s1
InChiKey RYZDNQQNCBNEHY-XMMPIXPASA-N
Formula C29H39Cl2N3O4 Molecular Weight 564.54
Cross Link CHEMBL462010
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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