oleandrin 🐶 Veterinary Use | Indications/Contra | FAERs-F | FAERs-M | Orange Bk | PK/Tox | Related Drugs | BioActivity |

Stem definitionDrug idCAS RN
3399 465-16-7

Description:

MoleculeDescription

Molfile Inchi Smiles

Synonyms:

  • oleandrin
  • corrigen
  • foliandrin
  • folinerin
  • neriostene
  • oleandrine
  • Molecular weight: 576.73
  • Formula: C32H48O9
  • CLOGP: 2.85
  • LIPINSKI: 1
  • HAC: 9
  • HDO: 2
  • TPSA: 120.75
  • ALOGS: -5.28
  • ROTB: 6

Drug dosage:

None

ADMET properties:

None

Predicted pharmacokinetic/toxicological properties (PK-AZ):

PropertyDescriptionValueUnitConfidenceSimilarity
azlogd74 LogD at pH 7.4 2.517 Moderate 0.67
caco2-efflux Caco-2 efflux ratio (BA/AB) 1.758 Moderate 0.67
caco2-intrinsic-papp Caco-2 intrinsic apparent permeability 55.847 10^-6 cm/s Moderate 0.67
dh-clint Dog hepatocyte intrinsic clearance 20.184 uL/min/10^6 cells Moderate 0.67
dppb Dog plasma protein binding (% unbound) 10.540 % Moderate 0.67
fcs-ppb Fetal calf serum protein binding (% unbound) 16.040 % Moderate 0.67
herg hERG pIC50 4.522 pIC50 Moderate 0.67
hh-clint Human hepatocyte intrinsic clearance 11.614 uL/min/10^6 cells Moderate 0.67
hlm-clint Human liver microsomal intrinsic clearance 46.989 uL/min/mg protein Moderate 0.67
hppb Human plasma protein binding (% unbound) 13.250 % Moderate 0.67
kinase-safety-class ACVR2B,CDK5,EIF2AK3,GRK2,ITK,PDK1,PDK2,PRKDC 8
mdck-mdr1-efflux MDCK-MDR1 efflux ratio 2.529 Moderate 0.67
mh-clint Mouse hepatocyte intrinsic clearance 63.973 Moderate 0.67
mppb Mouse plasma protein binding (% unbound) 9.280 Moderate 0.67
nih-mdck-mdr1-efflux NIH MDCK-MDR1 efflux ratio 7.211 Moderate 0.67
pfas-class PFAS structural alert (1 = True, 0 = False) 0
pppb Pig plasma protein binding (% unbound) 17.480 % Moderate 0.67
rh-clint Rat hepatocyte intrinsic clearance 46.238 uL/min/10^6 cells Moderate 0.67
rh-fuinc Rat hepatocyte fraction unbound in incubation 57.880 % Moderate 0.67
rppb Rat plasma protein binding (% unbound) 12.030 % Moderate 0.67
solubility-dd Solubility at pH 7.4 in DMSO 427.563 uM Moderate 0.67

Approvals:

None

FDA Adverse Event Reporting System (Female)

None

FDA Adverse Event Reporting System (Male)

None

FDA Adverse Event Reporting System (Geriatric)

None

FDA Adverse Event Reporting System (Pediatric)

None

Pharmacologic Action:

None

Drug Use | Suggest Off label Use Form| |View source of the data|

None




🐶 Veterinary Drug Use

None

🐶 Veterinary products

None

Acid dissociation constants calculated using MoKa v3.0.0

None

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
Neurogenic locus notch homolog protein 1 Membrane receptor IC50 6.92 CHEMBL

External reference:

IDSource
C0069397 UMLSCUI
CHEMBL4285883 ChEMBL_ID
DB12843 DRUGBANK_ID
C021065 MESH_SUPPLEMENTAL_RECORD_UI
12618 IUPHAR_LIGAND_ID
II95UDU7I4 UNII
11541511 PUBCHEM_CID
35871001 SNOMEDCT_US
CHEBI:59030 CHEBI

Pharmaceutical products:

None