diphenylamine-2-carboxylic acid   Click here for help

GtoPdb Ligand ID: 4182

Abbreviated name: DPC
Synonyms: fenamic acid | N-phenylanthranilic acid | NPA
PDB Ligand
Compound class: Synthetic organic
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2D Structure
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Physico-chemical Properties
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Hydrogen bond acceptors 3
Hydrogen bond donors 2
Rotatable bonds 3
Topological polar surface area 49.33
Molecular weight 213.08
XLogP 3.28
No. Lipinski's rules broken 0
SMILES / InChI / InChIKey
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Canonical SMILES OC(=O)c1ccccc1Nc1ccccc1
Isomeric SMILES OC(=O)c1ccccc1Nc1ccccc1
InChI InChI=1S/C13H11NO2/c15-13(16)11-8-4-5-9-12(11)14-10-6-2-1-3-7-10/h1-9,14H,(H,15,16)
InChI Key ZWJINEZUASEZBH-UHFFFAOYSA-N
Classification Click here for help
Compound class Synthetic organic
IUPAC Name Click here for help
2-(phenylamino)benzoic acid
Synonyms Click here for help
fenamic acid | N-phenylanthranilic acid | NPA
Database Links Click here for help
CAS Registry No. 91-40-7
ChEMBL Ligand CHEMBL23832
GtoPdb PubChem SID 178101001
PubChem CID 4386
RCSB PDB Ligand EHO
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Wikipedia Fenamic acid