CFam Chemical Families Database
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You are searching for "CFAMM00292610" in compound.

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CFAM Mol ID CFAMM00292610
Family CFFID3498 Reverse transcriptase Inhibitor UK-129485 Family
Superfamily CFSID2415 Reverse transcriptase Inhibitor UK-129485 Superfamily
Class CFCID346 Class 1696
External ID CHEMBL2170088 External Source CHEMBL
PubChem CID 59548322 Functional Category Bioactive
Molecule Name 4-[2-[(5-fluoro-6-methoxypyridin-3-yl)amino]-5-[(1R)-1-[(2S)-2-methyl-4-methylsulfonylpiperazin-1-yl]ethyl]pyridin-3-yl]-6-methyl-1,3,5-triazin-2-amine
IUPAC Name 4-[2-[(5-fluoro-6-methoxypyridin-3-yl)amino]-5-[(1R)-1-[(2S)-2-methyl-4-methylsulfonylpiperazin-1-yl]ethyl]pyridin-3-yl]-6-methyl-1,3,5-triazin-2-amine
Synonyms SureCN168889
InChi InChI=1S/C23H30FN9O3S/c1-13-12-32(37(5,34)35)6-7-33(13)14(2)16-8-18(21-28-15(3)29-23(25)31-21)20(26-10-16)30-17-9-19(24)22(36-4)27-11-17/h8-11,13-14H,6-7,12H2,1-5H3,(H,26,30)(H2,25,28,29,31)/t13-,14+/m0/s1
InChiKey SYUHGFRIKWMPPV-UONOGXRCSA-N
Formula C23H30FN9O3S Molecular Weight 531.61
Cross Link CHEMBL2170088
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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