brequinar

Ligand id: 7406

Name: brequinar

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 3
Hydrogen bond donors 1
Rotatable bonds 3
Topological polar surface area 50.19
Molecular weight 375.11
XLogP 7.03
No. Lipinski's rules broken 1

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
6-fluoro-2-[4-(2-fluorophenyl)phenyl]-3-methylquinoline-4-carboxylic acid
International Nonproprietary Names
INN number INN
6204 brequinar
Database Links
CAS Registry No. 96187-53-0
ChEMBL Ligand CHEMBL38434
DrugBank Ligand DB03523
PubChem CID 57030
RCSB PDB Ligand BRF
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