CFam Chemical Families Database
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You are searching for "CFAMM00524253" in compound.

Total 1 results found.

Click on CFAM IDs and names to search or view in CFAM, click on external IDs to view the entity in its source database.

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CFAM Mol ID CFAMM00524253
Family CFFBM44657 Melanocyte-stimulating hormone receptor and Melanocortin receptor 4 ligand N-[4-[(4-aminocyclohexyl)methyl]cyclohexyl]-N-[(E)-3-(2-bromo-4,5-dimethoxyphenyl)prop-2-enyl]-4-[2-[(4-hydroxyphenyl)methyl]-1H-indol-3-yl]butanamide family
Superfamily CFSBM14471 Melanocyte-stimulating hormone receptor and Melanocortin receptor 4 ligand N-[4-[(4-aminocyclohexyl)methyl]cyclohexyl]-N-[(E)-3-(2-bromo-4,5-dimethoxyphenyl)prop-2-enyl]-4-[2-[(4-hydroxyphenyl)methyl]-1H-indol-3-yl]butanamide Superfamily
Class CFCID1420 Class 2770
External ID CHEMBL396111 External Source CHEMBL
PubChem CID 44434763 Functional Category Bioactive
Molecule Name AGN-PC-076BU8
IUPAC Name N-[4-[(4-aminocyclohexyl)methyl]cyclohexyl]-N-[(2-chloro-4,5-dimethoxyphenyl)methyl]-4-[2-[(4-hydroxyphenyl)methyl]-1H-indol-3-yl]butanamide
Synonyms CHEBI:500973;N-[4-[(4-aminocyclohexyl)methyl]cyclohexyl]-N-[(2-chloro-4,5-dimethoxyphenyl)methyl]-4-[2-[(4-hydroxyphenyl)methyl]-1H-indol-3-yl]butanamide
InChi InChI=1S/C41H52ClN3O4/c1-48-39-24-30(36(42)25-40(39)49-2)26-45(32-18-12-28(13-19-32)22-27-10-16-31(43)17-11-27)41(47)9-5-7-35-34-6-3-4-8-37(34)44-38(35)23-29-14-20-33(46)21-15-29/h3-4,6,8,14-15,20-21,24-25,27-28,31-32,44,46H,5,7,9-13,16-19,22-23,26,43H2,1-2H3
InChiKey BIPSMDWSUSSJDS-UHFFFAOYSA-N
Formula C41H52ClN3O4 Molecular Weight 686.32
Cross Link CHEMBL396111
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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