CFam Chemical Families Database
BIDD Pharmainformatics Databases
You are searching for "CFAMM00060460" in compound.

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CFAM Mol ID CFAMM00060460
Family CFFAD428 Angiotensin-converting enzyme Inhibitor Moexipril Family
Superfamily CFSAD371 Angiotensin-converting enzyme Inhibitor Moexipril Superfamily
Class CFCAD92 Class 92
External ID CHEMBL455136 External Source CHEMBL
PubChem CID 23727689 Functional Category Bioactive
Molecule Name Almorexant
IUPAC Name (2R)-2-[(1S)-6,7-dimethoxy-1-[2-[4-(trifluoromethyl)phenyl]ethyl]-3,4-dihydro-1H-isoquinolin-2-yl]-N-methyl-2-phenylacetamide
Synonyms S2160_Selleck;ACT-078573;CHEBI:555140;Almorexant (INN);Almorexant [INN];(R)-2-((S)-6,7-Dimethoxy-1-(4-(trifluoromethyl)phenethyl)-3,4-dihydroisoquinolin-2(1H)-yl)-N-methyl-2-phenylacetamide;1266467-63-3;871224-64-5;SureCN196577
InChi InChI=1S/C29H31F3N2O3/c1-33-28(35)27(20-7-5-4-6-8-20)34-16-15-21-17-25(36-2)26(37-3)18-23(21)24(34)14-11-19-9-12-22(13-10-19)29(30,31)32/h4-10,12-13,17-18,24,27H,11,14-16H2,1-3H3,(H,33,35)/t24-,27+/m0/s1
Formula C29H31F3N2O3 Molecular Weight 512.56
Cross Link CHEMBL455136

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).

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