CFam Chemical Families Database
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You are searching for "CFAMM00332348" in compound.

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CFAM Mol ID CFAMM00332348
Family CFFBM2298 Potassium voltage-gated channel subfamily H member 2 and Kappa-type opioid receptor ligand 3-[[(1R,5S)-8-(pyridin-3-ylmethyl)-8-azabicyclo[3.2.1]octan-3-yl]oxy]benzamide family
Superfamily CFSID1744 Delta-type opioid receptor and Mu-type opioid receptor Ligand 6-(2-phenethylisoindolin-5-yloxy)nicotinamide Superfamily
Class CFCID1099 Class 2449
External ID CHEMBL122162 External Source CHEMBL
PubChem CID 44348180 Functional Category Bioactive
Molecule Name AGN-PC-0752OD
IUPAC Name N-(cyclopropylmethyl)-3-[3-(diaminomethylideneamino)oxypropoxy]-5-methyl-N-(pyridin-3-ylmethyl)benzamide
Synonyms CHEBI:302991;N-(cyclopropylmethyl)-3-[3-(diaminomethylideneamino)oxypropoxy]-5-methyl-N-(pyridin-3-ylmethyl)benzamide
InChi InChI=1S/C22H29N5O3/c1-16-10-19(12-20(11-16)29-8-3-9-30-26-22(23)24)21(28)27(14-17-5-6-17)15-18-4-2-7-25-13-18/h2,4,7,10-13,17H,3,5-6,8-9,14-15H2,1H3,(H4,23,24,26)
InChiKey QBJMPGMQHSMMOI-UHFFFAOYSA-N
Formula C22H29N5O3 Molecular Weight 411.50
Cross Link CHEMBL122162
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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