CFam Chemical Families Database
BIDD Pharmainformatics Databases
 
   
You are searching for "CFAMM00261729" 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 CFAMM00261729
Family CFFID2178 NAD(P)H dehydrogenase [quinone] 1 Inhibitor NSC-645827 Family
Superfamily CFSID1606 Ribosyldihydronicotinamide dehydrogenase [quinone] and NAD(P)H dehydrogenase [quinone] 1 Binder Superfamily
Class CFCID1025 Class 2375
External ID DNC007113 External Source TTD
PubChem CID 124496 Functional Category Investigative Drug
Molecule Name NSC-645827
IUPAC Name
Synonyms MLS002701557;NSC645827;AC1L3YJ7;CHEMBL95704;DNC007113;NCI60_015716;SMR001565158;C 1303;5-(2-(Diethylamino)ethylamino)-8-hydroxy-6H-(1,2,3)triazolo(4,5-1-de)acridin-6-one;5-(2-(dimethylamino)ethylamino)-8-hydroxy-6H-[1,3]triazolo[4,5,1-de]acridin-6-one
InChi InChI=1S/C17H17N5O2/c1-21(2)8-7-18-12-4-5-13-16-15(12)17(24)11-9-10(23)3-6-14(11)22(16)20-19-13/h3-6,9,18,23H,7-8H2,1-2H3
InChiKey OMSFZBMJHQNEQZ-UHFFFAOYSA-N
Formula C17H17N5O2 Molecular Weight 323.35
Cross Link CHEMBL95704
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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