CFam Chemical Families Database
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You are searching for "CFAMM00145870" 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 CFAMM00145870
Family CFFCD247 D(3) dopamine receptor Ligand GSK618334 Family
Superfamily CFSCD225 D(3) dopamine receptor Ligand GSK618334 Superfamily
Class CFCCD170 Class 983
External ID DCL000804 External Source TTD
PubChem CID 107970 Functional Category Clinical Trial Drug
Molecule Name Fingolimod
IUPAC Name 2-amino-2-[2-(4-octylphenyl)ethyl]propane-1,3-diol
Synonyms UNII-3QN8BYN5QF;2-Amino-2-[2-(4-octylphenyl)ethyl]propane-1,3-diol;AC1L332W;CHEMBL314854;162359-55-9;CHEBI:63115;CHEBI:244940;LS-187221;Gilenya (TN);2-Amino-2-(4-octylphenethyl)propane-1,3-diol
InChi InChI=1S/C19H33NO2/c1-2-3-4-5-6-7-8-17-9-11-18(12-10-17)13-14-19(20,15-21)16-22/h9-12,21-22H,2-8,13-16,20H2,1H3
InChiKey KKGQTZUTZRNORY-UHFFFAOYSA-N
Formula C19H33NO2 Molecular Weight 307.47
Cross Link CHEMBL314854 DB08868
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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