CFam Chemical Families Database
BIDD Pharmainformatics Databases
 
   
You are searching for "CFAMM00036330" 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 CFAMM00036330
Family CFFAD201 Benzodiazepine receptor Ligand Alprazolam Family
Superfamily CFSAD187 Benzodiazepine receptor Ligand Alprazolam Superfamily
Class CFCAD180 Class 180
External ID 18917638 External Source PubChem
PubChem CID 18917638 Functional Category Patent Compound
Molecule Name SureCN8879915
IUPAC Name 9-decyl-1,4-dimethyl-6-phenyl-4H-[1,2,4]triazolo[4,3-a][1,4]benzodiazepine
Synonyms AGN-PC-0226LP;9-decyl-1,4-dimethyl-6-phenyl-4H-[1,2,4]triazolo[4,3-a][1,4]benzodiazepine
InChi InChI=1S/C28H36N4/c1-4-5-6-7-8-9-10-12-15-23-18-19-25-26(20-23)32-22(3)30-31-28(32)21(2)29-27(25)24-16-13-11-14-17-24/h11,13-14,16-21H,4-10,12,15H2,1-3H3
InChiKey GZNKWTBOYTUVEQ-UHFFFAOYSA-N
Formula C28H36N4 Molecular Weight 428.61
Cross Link
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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