CFam Chemical Families Database
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You are searching for "CFAMM00331082" in compound.

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CFAM Mol ID CFAMM00331082
Family CFFBM2178 Growth hormone secretagogue receptor type 1 ligand (E)-5-amino-N-[(2R)-1-[[(2R)-3-(3,4-difluorophenyl)-1-[[(2S)-2-hydroxypropyl]amino]-1-oxopropan-2-yl]-methylamino]-3-naphthalen-2-yl-1-oxopropan-2-yl]-N,5-dimethylhex-2-enamide family
Superfamily CFSBM342 Cruzipain and Cathepsin F Binder Superfamily
Class CFCID4 Class 1354
External ID CHEMBL332987 External Source CHEMBL
PubChem CID 10579444 Functional Category Bioactive
Molecule Name SureCN6325980
IUPAC Name (E)-5-amino-N,5-dimethyl-N-[(2R)-1-[methyl-[(2R)-1-oxo-1-(oxolan-2-ylmethylamino)-3-phenylpropan-2-yl]amino]-3-naphthalen-1-yl-1-oxopropan-2-yl]hex-2-enamide
Synonyms CHEBI:302772
InChi InChI=1S/C36H46N4O4/c1-36(2,37)21-11-20-33(41)39(3)32(24-28-17-10-16-27-15-8-9-19-30(27)28)35(43)40(4)31(23-26-13-6-5-7-14-26)34(42)38-25-29-18-12-22-44-29/h5-11,13-17,19-20,29,31-32H,12,18,21-25,37H2,1-4H3,(H,38,42)/b20-11+/t29?,31-,32-/m1/s1
InChiKey QRKMAIWQNUXEDA-CJLITUQLSA-N
Formula C36H46N4O4 Molecular Weight 598.77
Cross Link CHEMBL332987
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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