nefazodone

Ligand id: 7247

Name: nefazodone

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View more information in the IUPHAR Pharmacology Education Project: nefazodone

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 6
Hydrogen bond donors 0
Rotatable bonds 10
Topological polar surface area 39.26
Molecular weight 469.22
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 GPCRs
Key to terms and symbols Click column headers to sort
Target Sp. Type Action Affinity Units Concentration range (M) Reference
5-HT2A receptor Hs Antagonist Antagonist 8.2 pKi - 3
pKi 8.2 (Ki 5.8x10-9 M) [3]
Selectivity at enzymes
Key to terms and symbols Click column headers to sort
Target Sp. Type Action Affinity Units Concentration range (M) Reference
CYP3A4 Hs Inhibitor Inhibition 6.0 pKi - 2,4
pKi 6.0 (Ki 1x10-6 M) [2,4]
Selectivity at transporters
Key to terms and symbols Click column headers to sort
Target Sp. Type Action Affinity Units Concentration range (M) Reference
SERT Hs Inhibitor Inhibition 6.7 pKd - 1
pKd 6.7 (Kd 2x10-7 M) [1]
NET Hs Inhibitor Inhibition 6.4 pKd - 1
pKd 6.4 (Kd 3.6x10-7 M) [1]
Description: Dissociation constant of [3H]- nisoxatine vs. nefazodone.