dibutyl phthalate

Ligand id: 6295

Name: dibutyl phthalate

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 4
Hydrogen bond donors 0
Rotatable bonds 10
Topological polar surface area 52.6
Molecular weight 278.15
XLogP 5.03
No. Lipinski's rules broken 1

Molecular properties generated using the CDK

View interactive charts of activity data from GtoPdb and ChEMBL (where available) across species

Selectivity at ion channels
Key to terms and symbols Click column headers to sort
Target Sp. Type Action Affinity Units Concentration range (M) Reference
TRPA1 Hs Activator Activation 4.6 pEC50 - 1
pEC50 4.6 [1]
Description: Calcium imaging
Conditions: CHO cells stably expressing human TRPA1 loaded with Fluo-4