CFam Chemical Families Database
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You are searching for "CFAMM00437493" in compound.

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CFAM Mol ID CFAMM00437493
Family CFFBM16240 Cannabinoid receptor 2 and Cannabinoid receptor 1 ligand 4-[6-[(2R,5S)-2,5-dimethylpyrrolidin-1-yl]pyridazin-3-yl]isoquinoline family
Superfamily CFSBM6798 Smoothened homolog and Cannabinoid receptor 2 Binder Superfamily
Class CFCID704 Class 2054
External ID 54568954 External Source PubChem
PubChem CID 54568954 Functional Category Patent Compound
Molecule Name AGN-PC-0A3G7W
IUPAC Name 2-[4-methyl-3-(4-pyrrolidin-1-ylphenyl)-5-[2-(4-pyrrolidin-1-ylphenyl)ethenyl]-3,4-dihydropyrazol-2-yl]pyridine
Synonyms 2-[4-methyl-3-(4-pyrrolidin-1-ylphenyl)-5-[2-(4-pyrrolidin-1-ylphenyl)ethenyl]-3,4-dihydropyrazol-2-yl]pyridine
InChi InChI=1S/C31H35N5/c1-24-29(18-11-25-9-14-27(15-10-25)34-20-4-5-21-34)33-36(30-8-2-3-19-32-30)31(24)26-12-16-28(17-13-26)35-22-6-7-23-35/h2-3,8-19,24,31H,4-7,20-23H2,1H3
InChiKey ZVWFLUPSDOGVBA-UHFFFAOYSA-N
Formula C31H35N5 Molecular Weight 477.64
Cross Link
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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