CFam Chemical Families Database
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You are searching for "CFAMM00449495" in compound.

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CFAM Mol ID CFAMM00449495
Family CFFBM18868 Glutaminyl-peptide cyclotransferase inhibitor AGN-PC-077IHD family
Superfamily CFSBM3755 Alpha-1A adrenergic receptor and Alpha-2A adrenergic receptor Binder Superfamily 2
Class CFCCD283 Class 1096
External ID CHEMBL583368 External Source CHEMBL
PubChem CID 44549233 Functional Category Bioactive
Molecule Name AGN-PC-077IHD
IUPAC Name 1-(3,4-dimethoxyphenyl)-N-[3-(5-methylimidazol-1-yl)propyl]cyclopropane-1-carbothioamide
Synonyms CHEBI:673921;1-(3,4-dimethoxyphenyl)-N-[3-(5-methylimidazol-1-yl)propyl]cyclopropane-1-carbothioamide
InChi InChI=1S/C19H25N3O2S/c1-14-12-20-13-22(14)10-4-9-21-18(25)19(7-8-19)15-5-6-16(23-2)17(11-15)24-3/h5-6,11-13H,4,7-10H2,1-3H3,(H,21,25)
InChiKey OGHXVAKUSIYDSB-UHFFFAOYSA-N
Formula C19H25N3O2S Molecular Weight 359.49
Cross Link CHEMBL583368
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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