(+)-5-(5-bromothiophen-3-yl)-5-methyl-4-oxo-4,5-dihydro-furan-2-carboxylic acid

Ligand id: 1589

Name: (+)-5-(5-bromothiophen-3-yl)-5-methyl-4-oxo-4,5-dihydro-furan-2-carboxylic acid

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 4
Hydrogen bond donors 1
Rotatable bonds 2
Topological polar surface area 91.84
Molecular weight 301.92
XLogP 1.79
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
5-(5-bromothiophen-3-yl)-5-methyl-4-oxofuran-2-carboxylic acid
Database Links
BindingDB Ligand 50208137
ChEMBL Ligand CHEMBL375493
GtoPdb PubChem SID 135649821
PubChem CID 11483496
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