CFam Chemical Families Database
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You are searching for "CFAMM00298113" in compound.

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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 CFAMM00298113
Family CFFID3812 Sodium-dependent dopamine transporter and Sodium-dependent noradrenaline transporter Inhibitor D-254C Family
Superfamily CFSID2567 Sodium-dependent dopamine transporter and Sodium-dependent noradrenaline transporter Binder Superfamily 4
Class CFCID1519 Class 2869
External ID DNC013564 External Source TTD
PubChem CID 16040321 Functional Category Investigative Drug
Molecule Name D-254C
IUPAC Name (2R)-1-[[(3S,6S)-6-benzhydrylpiperidin-3-yl]amino]-3-phenylpropan-2-ol
Synonyms D-254C;SureCN4886148;DNC013564
InChi InChI=1S/C27H32N2O/c30-25(18-21-10-4-1-5-11-21)20-28-24-16-17-26(29-19-24)27(22-12-6-2-7-13-22)23-14-8-3-9-15-23/h1-15,24-30H,16-20H2/t24-,25+,26-/m0/s1
InChiKey YKFRXVGLZNKBAS-NXCFDTQHSA-N
Formula C27H32N2O Molecular Weight 400.56
Cross Link CHEMBL258725
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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