CFam Chemical Families Database
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You are searching for "CFAMM00489700" in compound.

Total 1 results found.

Click on CFAM IDs and names to search or view in CFAM, click on external IDs to view the entity in its source database.

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CFAM Mol ID CFAMM00489700
Family CFFBM29638 Sigma non-opioid intracellular receptor 1 and Muscarinic acetylcholine receptor M2 ligand AGN-PC-074I5X family
Superfamily CFSID2739 Sodium-dependent dopamine transporter Inhibitor (+/-)-threo-3',4'-dichloromethylphenidate Amide Superfamily
Class CFCID1625 Class 2975
External ID CHEMBL73501 External Source CHEMBL
PubChem CID 44313489 Functional Category Bioactive
Molecule Name AGN-PC-074I5X
IUPAC Name 1-(3,4-dichlorophenyl)-N-[2-(diethylamino)ethoxymethyl]cyclohexane-1-carboxamide
Synonyms CHEBI:218592;1-(3,4-dichlorophenyl)-N-[2-(diethylamino)ethoxymethyl]cyclohexane-1-carboxamide
InChi InChI=1S/C20H30Cl2N2O2/c1-3-24(4-2)12-13-26-15-23-19(25)20(10-6-5-7-11-20)16-8-9-17(21)18(22)14-16/h8-9,14H,3-7,10-13,15H2,1-2H3,(H,23,25)
InChiKey WEHSOOUZRJEYJK-UHFFFAOYSA-N
Formula C20H30Cl2N2O2 Molecular Weight 401.37
Cross Link CHEMBL73501
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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