TTNPB

Ligand Id: 2646
Ligand name TTNPB

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 2
Hydrogen bond donors 1
Rotatable bonds 3
Topological polar surface area 37.3
Molecular weight 348.21
XLogP 10.98
No. Lipinski's rules broken 1

Molecular properties generated using the CDK


Classification
Compound class Synthetic organic
DrugBank groups experimental
IUPAC Name
4-[(E)-2-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)prop-1-enyl]benzoic acid
Database Links
BindingDB Ligand 50032219
CAS Registry No. 71441-28-6 (source: DrugBank)
ChEBI CHEBI:111254
ChEMBL Ligand 240898, 111254, 373364, 373365, 373366, 373876
DrugBank Ligand DB02877
NURSA Ligand li50
PubChem CID 5289501
RCSB PDB Ligand TTB
Search Google for chemical match using the InChIKey FOIVPCKZDPCJJY-JQIJEIRASA-N
Search Google for chemicals with the same backbone FOIVPCKZDPCJJY
ZINC ZINC04475360