compound 19 [PMID: 7707314]

Ligand id: 8892

Name: compound 19 [PMID: 7707314]

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 7
Hydrogen bond donors 1
Rotatable bonds 1
Topological polar surface area 92.62
Molecular weight 441.03
XLogP 2.16
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
Comments
Compound 19 is reported as an inhibitor of topoisomerase I [1].
Database Links
BindingDB Ligand 50034013
ChEMBL Ligand CHEMBL13935
GtoPdb PubChem SID 310264673
PubChem CID 10460355
Search Google for chemical match using the InChIKey WBLBIGPXRKCBEI-FQEVSTJZSA-N
Search Google for chemicals with the same backbone WBLBIGPXRKCBEI
Search UniChem for chemical match using the InChIKey WBLBIGPXRKCBEI-FQEVSTJZSA-N
Search UniChem for chemicals with the same backbone WBLBIGPXRKCBEI