CFam Chemical Families Database
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You are searching for "CFAMM00181617" in compound.

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CFAM Mol ID CFAMM00181617
Family CFFID116 Cyclin-dependent kinase 5 Inhibitor 9-nitropaullone Family
Superfamily CFSID89 Histone deacetylase and Cyclin-dependent kinase 5 Binder Superfamily
Class CFCID60 Class 1410
External ID DNC000116 External Source TTD
PubChem CID 5005498 Functional Category Investigative Drug
Molecule Name 9-Nitropaullone
IUPAC Name 9-nitro-7,12-dihydro-5H-indolo[3,2-d][1]benzazepin-6-one
Synonyms 9-Nitropaullone;Paullone Analog 1;AC1NMCUD;NSC-705701;SureCN2170104;MLS002702475;NSC 705701;9-Nitro-7,12-dihydroindolo[3,2-d][1]benzazepin-6(5H)-one;14-nitro-8,18-diazatetracyclo[9.7.0.0?,?.0??,??]octadeca-1(11),2,4,6,12(17),13,15-heptaen-9-one;Kinome_3754
InChi InChI=1S/C16H11N3O3/c20-15-8-12-11-7-9(19(21)22)5-6-14(11)18-16(12)10-3-1-2-4-13(10)17-15/h1-7,18H,8H2,(H,17,20)
InChiKey OLUKILHGKRVDCT-UHFFFAOYSA-N
Formula C16H11N3O3 Molecular Weight 293.28
Cross Link CHEMBL50894 DB04014
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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