desipramine

Ligand id: 2399

Name: desipramine

IUPHAR Pharmacology Education Project (PEP) logo

View more information in the IUPHAR Pharmacology Education Project: desipramine

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 2
Hydrogen bond donors 1
Rotatable bonds 4
Topological polar surface area 15.27
Molecular weight 266.18
XLogP 5
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

Transporters Moving this Compound Across a Lipid Membrane
Transporter EC number Reaction Reference
Organic cation transporter 1
Selectivity at ion channels
Key to terms and symbols Click column headers to sort
Target Sp. Type Action Affinity Units Concentration range (M) Reference
Kir3.2 Mm Channel blocker Antagonist 4.4 pIC50 - 3
pIC50 4.4 Data obtained using Kir3.1/3.2 heteromer [3]
Voltage: -70.0 mV
Kir3.4 Mm Channel blocker Antagonist 4.3 pIC50 - 3
pIC50 4.3 [3]
Voltage: -70.0 mV
Selectivity at transporters
Key to terms and symbols Click column headers to sort
Target Sp. Type Action Affinity Units Concentration range (M) Reference
NET Hs Inhibitor Inhibition 8.7 pKi - 4
pKi 8.7 (Ki 2.1x10-9 M) [4]
SERT Rn Inhibitor Inhibition 7.7 pKi - 1
pKi 7.7 (Ki 2x10-8 M) [1]
SERT Hs Inhibitor Inhibition 6.8 pKi - 5
pKi 6.8 (Ki 1.63x10-7 M) [5]
Description: Assay using HEK-293 cells transfected with hSERT
Plasma membrane monoamine transporter Hs Inhibitor Inhibition 4.5 pKi - 2,6
pKi 4.5 (Ki 3.26x10-5 M) [2,6]