CFam Chemical Families Database
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You are searching for "CFAMM00006254" in compound.

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CFAM Mol ID CFAMM00006254
Family CFFAD23 Sodium-dependent dopamine transporter inhibitor substituted phenethylamine derivative Methylphenidate family
Superfamily CFSAD23 Sodium-dependent dopamine transporter inhibitor substituted phenethylamine derivative Methylphenidate Superfamily
Class CFCAD23 Class 23
External ID DAP000024 External Source TTD
PubChem CID 4158 Functional Category Approved Drug
Molecule Name Methylphenidate
IUPAC Name methyl 2-phenyl-2-piperidin-2-ylacetate
Synonyms Daytrana;Methylphenidan;Phenidylate;Methylin;Metilfenidato;Calocain;Plimasine;Concerta;Meridil;Ritalin
InChi InChI=1S/C14H19NO2/c1-17-14(16)13(11-7-3-2-4-8-11)12-9-5-6-10-15-12/h2-4,7-8,12-13,15H,5-6,9-10H2,1H3
InChiKey DUGOZIWVEXMGBE-UHFFFAOYSA-N
Formula C14H19NO2 Molecular Weight 233.31
Cross Link CHEMBL796 DB00422
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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