benzatropine

Ligand id: 7601

Name: benzatropine

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 2
Hydrogen bond donors 0
Rotatable bonds 4
Topological polar surface area 12.47
Molecular weight 307.19
XLogP 6.85
No. Lipinski's rules broken 1

Molecular properties generated using the CDK

View interactive charts of activity data from ChEMBL and GtoPdb across species (New!)

Selectivity at human transporters
Key to terms and symbols Click column headers to sort
Target Type Action Affinity Units Concentration range (M) Reference
B0AT1 Inhibitor Inhibition 4.4 pIC50 - 1
pIC50 4.4 (IC50 4.4x10-5 M) [1]
Selectivity at rat GPCRs
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Target Type Action Affinity Units Concentration range (M) Reference
M1 receptor Antagonist Antagonist 9.0 pKi - 3
pKi 9.0 (Ki 9.5x10-10 M) [3]
Description: Displacement binding experiment using homogenised rat caudate putamen.
M2 receptor Antagonist Antagonist 8.6 pKi - 3
pKi 8.6 (Ki 2.6x10-9 M) [3]
Description: Displacement binding assay using homogenised rat caudate putamen.
Selectivity at rat transporters
Key to terms and symbols Click column headers to sort
Target Type Action Affinity Units Concentration range (M) Reference
DAT Inhibitor Inhibition 6.9 pKi - 3
pKi 6.9 (Ki 1.18x10-7 M) [3]
Description: Displacement of [3H]WIN35,428 binding to homogenised rat caudate putamen.