quinpirole

Ligand id: 2

Name: quinpirole

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 3
Hydrogen bond donors 1
Rotatable bonds 2
Topological polar surface area 31.92
Molecular weight 219.17
XLogP 2.3
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
(4aR,8aR)-5-propyl-1,4,4a,6,7,8,8a,9-octahydropyrido[2,3-f]indazole
International Nonproprietary Names
INN number INN
5610 quinpirole
Synonyms
(-)-quinpirole
Database Links
BindingDB Ligand 50221678
CAS Registry No. 80373-22-4 (source: Scifinder)
ChEBI CHEBI:75401
ChEMBL Ligand CHEMBL240773
GtoPdb PubChem SID 135650874
PubChem CID 54562
Search Google for chemical match using the InChIKey FTSUPYGMFAPCFZ-ZWNOBZJWSA-N
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Search UniChem for chemical match using the InChIKey FTSUPYGMFAPCFZ-ZWNOBZJWSA-N
Search UniChem for chemicals with the same backbone FTSUPYGMFAPCFZ
Wikipedia Quinpirole