CFam Chemical Families Database
BIDD Pharmainformatics Databases
 
   
You are searching for "CFAMM00418958" 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 CFAMM00418958
Family CFFBM12916 Melanocortin receptor 4 and Cytochrome P450 3A4 ligand 2-amino-N-[(1S)-1-[2-[4-[(2R)-3-(2,4-dichlorophenyl)-2-(2-oxopyrrolidin-1-yl)propanoyl]piperazin-1-yl]-5-fluorophenyl]-3-methylbutyl]acetamide family
Superfamily CFSBM1408 Melanocortin receptor 4 and Prelamin-A/C Binder Superfamily
Class CFCID25 Class 1375
External ID CHEMBL396434 External Source CHEMBL
PubChem CID 44433289 Functional Category Bioactive
Molecule Name (2R)-2-amino-N-[(1S)-1-[2-[4-[(2R)-3-(2,4-dichlorophenyl)-2-(2-oxopyrrolidin-1-yl)propanoyl]piperazin-1-yl]-5-fluorophenyl]-3-methylbutyl]propanamide
IUPAC Name (2R)-2-amino-N-[(1S)-1-[2-[4-[(2R)-3-(2,4-dichlorophenyl)-2-(2-oxopyrrolidin-1-yl)propanoyl]piperazin-1-yl]-5-fluorophenyl]-3-methylbutyl]propanamide
Synonyms CHEBI:498505
InChi InChI=1S/C31H40Cl2FN5O3/c1-19(2)15-26(36-30(41)20(3)35)24-18-23(34)8-9-27(24)37-11-13-38(14-12-37)31(42)28(39-10-4-5-29(39)40)16-21-6-7-22(32)17-25(21)33/h6-9,17-20,26,28H,4-5,10-16,35H2,1-3H3,(H,36,41)/t20-,26+,28-/m1/s1
InChiKey MAHFSCYTEUPDKY-NBYOPXRUSA-N
Formula C31H40Cl2FN5O3 Molecular Weight 620.59
Cross Link CHEMBL396434
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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