ACAA

Ligand id: 2443

Name: ACAA

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 4
Hydrogen bond donors 2
Rotatable bonds 9
Topological polar surface area 66.4
Molecular weight 337.17
XLogP 8.5
No. Lipinski's rules broken 1

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
2-[3-(4-pentylphenyl)prop-2-enoylamino]benzoic acid
Synonyms
ACA
Database Links
BindingDB Ligand 50023173
CAS Registry No. 110683-10-8 (source: Scifinder)
ChEMBL Ligand CHEMBL173443
PubChem CID 5353376
Search Google for chemical match using the InChIKey GAMRBCZMOOMBSQ-CCEZHUSRSA-N
Search Google for chemicals with the same backbone GAMRBCZMOOMBSQ
Search UniChem for chemical match using the InChIKey GAMRBCZMOOMBSQ-CCEZHUSRSA-N
Search UniChem for chemicals with the same backbone GAMRBCZMOOMBSQ