QO-58

Ligand id: 7669

Name: QO-58

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 5
Hydrogen bond donors 1
Rotatable bonds 3
Topological polar surface area 59.81
Molecular weight 442
XLogP 6.34
No. Lipinski's rules broken 1

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
5-(2,6-dichloro-5-fluoropyridin-3-yl)-3-phenyl-2-(trifluoromethyl)-1H-pyrazolo[1,5-a]pyrimidin-7-one
Database Links
BindingDB Ligand 50339281
ChEMBL Ligand CHEMBL1689654
PubChem CID 51351551
Search Google for chemical match using the InChIKey JEXACLGXUUYXDX-UHFFFAOYSA-N
Search Google for chemicals with the same backbone JEXACLGXUUYXDX
Search UniChem for chemical match using the InChIKey JEXACLGXUUYXDX-UHFFFAOYSA-N
Search UniChem for chemicals with the same backbone JEXACLGXUUYXDX
Comments
PubChem CID 51351551 represents an alternative isomer of this compound.