picrotin Indications/Contra | FAERs-F | FAERs-M | Orange Bk | BioActivity |

Stem definitionDrug idCAS RN
2163 21416-53-5

Description:

MoleculeDescription

Molfile Inchi Smiles

Synonyms:

  • picrotin
the less toxic component of picrotoxin lacking GABA activity
  • Molecular weight: 310.30
  • Formula: C15H18O7
  • CLOGP: -1.61
  • LIPINSKI: 0
  • HAC: 7
  • HDO: 2
  • TPSA: 105.59
  • ALOGS: -1.10
  • ROTB: 1

Drug dosage:

None

ADMET properties:

None

Approvals:

None

FDA Adverse Event Reporting System (Female)

None

FDA Adverse Event Reporting System (Male)

None

Pharmacologic Action:

None

Drug Use (View source of the data)

None

Acid dissociation constants calculated using MoKa v3.0.0

Dissociation levelDissociation constantType (acidic/basic)
pKa1 13.46 acidic

Orange Book patent data (new drug applications)

None

Orange Book exclusivity data (new drug applications)

None

Bioactivity Summary:

TargetClassPharosUniProtActionTypeActivity value
(-log[M])
Mechanism
action
Bioact sourceMoA source
Glycine receptor subunit alpha-3 Ion channel IC50 5.22 CHEMBL
Glycine receptor subunit alpha-1 Ion channel IC50 5.28 CHEMBL
Glycine receptor subunit beta Ion channel BLOCKER IC50 4.60 IUPHAR
Glycine receptor subunit alpha-2 Ion channel BLOCKER IC50 4.90 IUPHAR

External reference:

IDSource
C0916220 UMLSCUI
CHEMBL478523 ChEMBL_ID
4286 IUPHAR_LIGAND_ID
C411705 MESH_SUPPLEMENTAL_RECORD_UI
U06Z6QD7N2 UNII
442291 PUBCHEM_CID

Pharmaceutical products:

None