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

Stem definitionDrug idCAS RN
analgesics, pethidine derivatives and other synthetic small molecule miu-opioid receptor agonists 3288 468-56-4

Description:

MoleculeDescription

Molfile Inchi Smiles

Synonyms:

  • hydroxypethidine
  • bemidone
  • demidone
  • emidone
  • oxipethidine
  • oxydolantin
  • oxypetidin
  • Molecular weight: 263.34
  • Formula: C15H21NO3
  • CLOGP: 1.56
  • LIPINSKI: 0
  • HAC: 4
  • HDO: 1
  • TPSA: 49.77
  • ALOGS: -1.62
  • ROTB: 4

Drug dosage:

None

ADMET properties:

None

Predicted pharmacokinetic/toxicological properties (PK-AZ):

PropertyDescriptionValueUnitConfidenceSimilarity
azlogd74 LogD at pH 7.4 0.762 Moderate 0.74
caco2-efflux Caco-2 efflux ratio (BA/AB) 2.655 Moderate 0.74
caco2-intrinsic-papp Caco-2 intrinsic apparent permeability 5.105 10^-6 cm/s Moderate 0.74
dh-clint Dog hepatocyte intrinsic clearance 11.117 uL/min/10^6 cells Moderate 0.74
dppb Dog plasma protein binding (% unbound) 83.530 % Moderate 0.74
fcs-ppb Fetal calf serum protein binding (% unbound) 80.070 % Moderate 0.74
herg hERG pIC50 4.340 pIC50 Moderate 0.74
hh-clint Human hepatocyte intrinsic clearance 4.111 uL/min/10^6 cells Moderate 0.74
hlm-clint Human liver microsomal intrinsic clearance 6.808 uL/min/mg protein Moderate 0.74
hppb Human plasma protein binding (% unbound) 82.150 % Moderate 0.74
kinase-safety-class ACVR2A,ACVR2B,AKT2,AURKA,AXL,BRAF,BTK,CAMK2B,CAMK2D,CDK2,CDK4,CDK5,CDK9,DDR1,DYRK1B,EIF2AK3,EPHB4,ERBB2,FLT3,GRK2,ITK,JAK2,JAK3,MAP2K6,MAP3K21,MAP3K7,MAPK10,MAPK7,MAPK9,MAPKAPK2,MET,MTOR,NTRK2,PDK2,PDK4,PDPK1,PIK3CB,PIM2,PLK1,PRKCD,PRKDC,SIK2,SIK3,STK33,SYK,TEK,TGFBR1,TTK,ZAP70 49
kinase-selectivity-class ACVR2B,AXL,DDR1,EIF2AK3,EPHB4,GRK2,PDK4,SIK2,STK33,TEK 10
mdck-mdr1-efflux MDCK-MDR1 efflux ratio 3.327 Moderate 0.74
mh-clint Mouse hepatocyte intrinsic clearance 103.992 Moderate 0.74
mppb Mouse plasma protein binding (% unbound) 83.330 Moderate 0.74
nih-mdck-mdr1-efflux NIH MDCK-MDR1 efflux ratio 8.017 Moderate 0.74
pfas-class PFAS structural alert (1 = True, 0 = False) 0
pppb Pig plasma protein binding (% unbound) 84.930 % Moderate 0.74
rh-clint Rat hepatocyte intrinsic clearance 37.931 uL/min/10^6 cells Moderate 0.74
rh-fuinc Rat hepatocyte fraction unbound in incubation 89.890 % Moderate 0.74
rppb Rat plasma protein binding (% unbound) 72.770 % Moderate 0.74
solubility-dd Solubility at pH 7.4 in DMSO 897.429 uM Moderate 0.74

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

Dissociation levelDissociation constantType (acidic/basic)
pKa1 9.55 acidic
pKa2 8.56 Basic

Orange Book patent data (new drug applications)

None

Orange Book exclusivity data (new drug applications)

None

Bioactivity Summary:

None

External reference:

IDSource
C2825263 UMLSCUI
CHEBI:135085 CHEBI
CHEMBL1182665 ChEMBL_ID
CHEMBL259165 ChEMBL_ID
61120 PUBCHEM_CID
C530875 MESH_SUPPLEMENTAL_RECORD_UI
219 INN_ID
W1J43H2B3K UNII

Pharmaceutical products:

None