CFam Chemical Families Database
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You are searching for "CFAMM00268207" 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 CFAMM00268207
Family CFFID2438 Serine/threonine-protein kinase Chk1 Inhibitor 6-(3-aminopropyl)benzo[h]isoquinolin-1(2h)-one Family
Superfamily CFSID1772 Serine/threonine-protein kinase Chk1 Inhibitor 6-(3-aminopropyl)benzo[h]isoquinolin-1(2h)-one Superfamily
Class CFCID1113 Class 2463
External ID DNC008055 External Source TTD
PubChem CID 44443516 Functional Category Investigative Drug
Molecule Name 6-(3-aminopropyl)benzo[h]isoquinolin-1(2H)-one
IUPAC Name 6-(3-aminopropyl)-2H-benzo[h]isoquinolin-1-one
Synonyms CHEMBL250222;CHEBI:516084;DNC008055;6-(3-aminopropyl)benzo[h]isoquinolin-1(2H)-one
InChi InChI=1S/C16H16N2O/c17-8-3-4-11-10-12-7-9-18-16(19)15(12)14-6-2-1-5-13(11)14/h1-2,5-7,9-10H,3-4,8,17H2,(H,18,19)
InChiKey LBNJYZFAUIDIPA-UHFFFAOYSA-N
Formula C16H16N2O Molecular Weight 252.31
Cross Link CHEMBL250222
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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