octanol   

GtoPdb Ligand ID: 4278

2D Structure
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Physico-chemical Properties
Hydrogen bond acceptors 1
Hydrogen bond donors 1
Rotatable bonds 6
Topological polar surface area 20.23
Molecular weight 130.14
XLogP 3.13
No. Lipinski's rules broken 0
SMILES / InChI / InChIKey
Canonical SMILES CCCCCCCCO
Isomeric SMILES CCCCCCCCO
InChI InChI=1S/C8H18O/c1-2-3-4-5-6-7-8-9/h9H,2-8H2,1H3
InChI Key KBPLFHHGFOOTCA-UHFFFAOYSA-N
Selectivity at ion channels
Key to terms and symbols Click column headers to sort
Target Sp. Type Action Value Parameter Concentration range (M) Reference
Cx23 Hs Inhibitor - - - -
Cx25 Hs Inhibitor - - - -
Cx26 Hs Inhibitor - - - -
Cx30 Hs Inhibitor - - - -
Cx30.2 Hs Inhibitor - - - -
Cx30.3 Hs Inhibitor - - - -
Cx31 Hs Inhibitor - - - -
Cx31.1 Hs Inhibitor - - - -
Cx31.9 Hs Inhibitor - - - -
Cx32 Hs Inhibitor - - - -
Cx36 Hs Inhibitor - - - -
Cx37 Hs Inhibitor - - - -
Cx40 Hs Inhibitor - - - -
Cx40.1 Hs Inhibitor - - - -
Cx43 Hs Inhibitor - - - -
Cx45 Hs Inhibitor - - - -
Cx46 Hs Inhibitor - - - -
Cx47 Hs Inhibitor - - - -
Cx50 Hs Inhibitor - - - -
Cx59 Hs Inhibitor - - - -
Cx62 Hs Inhibitor - - - -