CFam Chemical Families Database
BIDD Pharmainformatics Databases
 
   
You are searching for "CFAMM00333036" 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 CFAMM00333036
Family CFFBM2350 Adenosine receptor A2b and Adenosine receptor A2a ligand CP-66713 family
Superfamily CFSBM1308 Reverse transcriptase/RNaseH and GABA theta subunit Binder Superfamily
Class CFCID1021 Class 2371
External ID CHEMBL2313240 External Source CHEMBL
PubChem CID 71151981 Functional Category Bioactive
Molecule Name 1-[[1-(2-chlorophenyl)-4-methyl-[1,2,4]triazolo[4,3-a]quinoxalin-8-yl]methyl]piperidin-4-ol
IUPAC Name 1-[[1-(2-chlorophenyl)-4-methyl-[1,2,4]triazolo[4,3-a]quinoxalin-8-yl]methyl]piperidin-4-ol
Synonyms SureCN14359638
InChi InChI=1S/C22H22ClN5O/c1-14-21-25-26-22(17-4-2-3-5-18(17)23)28(21)20-12-15(6-7-19(20)24-14)13-27-10-8-16(29)9-11-27/h2-7,12,16,29H,8-11,13H2,1H3
InChiKey OIOIOFDJPMGWSE-UHFFFAOYSA-N
Formula C22H22ClN5O Molecular Weight 407.90
Cross Link CHEMBL2313240
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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