Ligand id: 6464

Name: doxycycline

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 9
Hydrogen bond donors 6
Rotatable bonds 2
Topological polar surface area 181.62
Molecular weight 444.15
XLogP 0.43
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 enzymes
Key to terms and symbols Click on species/strain names for details Click column headers to sort
Target Sp. Type Action Affinity Units Concentration range (M) Reference
MMP7 Hs Inhibitor Inhibition 4.1 pKd - 2
pKd 4.1 (Kd 7.3x10-5 M) [2]
MMP8 Hs Inhibitor Inhibition 4.6 pIC50 - 3
pIC50 4.6 (IC50 2.6x10-5 M) [3]