topotecan

Ligand id: 7101

Name: topotecan

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 7
Hydrogen bond donors 2
Rotatable bonds 3
Topological polar surface area 103.2
Molecular weight 421.16
XLogP 0.99
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

Classification
Compound class Natural product or derivative
Approved drug? Yes (source: EMA and FDA (1996))
International Nonproprietary Names
INN number INN
6783 topotecan
Synonyms
Hycamtin®
SK-S-104864-A
Database Links
CAS Registry No. 123948-87-8
ChEBI CHEBI:63632
ChEMBL Ligand CHEMBL84
DrugBank Ligand DB01030
PubChem CID 60700
RCSB PDB Ligand TTC
Search Google for chemical match using the InChIKey UCFGDBYHRUNTLO-QHCPKHFHSA-N
Search Google for chemicals with the same backbone UCFGDBYHRUNTLO
Search PubMed clinical trials topotecan
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Wikipedia topotecan
Comments
Topotecan is an analogue of camptothecin, an anticancer drug which causes DNA strand breaks.
Marketed formulations may contain topotecan hydrochloride (PubChem CID 60699).