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

Stem definitionDrug idCAS RN
4768 90-43-7

Description:

MoleculeDescription

Molfile Inchi Smiles

Synonyms:

  • biphenylol
  • 2-Biphenylol
  • preventol
  • Molecular weight: 170.21
  • Formula: C12H10O
  • CLOGP: 3.06
  • LIPINSKI: 0
  • HAC: 1
  • HDO: 1
  • TPSA: 20.23
  • ALOGS: -2.70
  • ROTB: 1

Drug dosage:

None

ADMET properties:

None

Predicted pharmacokinetic/toxicological properties (PK-AZ):

PropertyDescriptionValueUnitConfidenceSimilarity
azlogd74 LogD at pH 7.4 3.058 High 0.89
caco2-efflux Caco-2 efflux ratio (BA/AB) 0.343 High 0.89
caco2-intrinsic-papp Caco-2 intrinsic apparent permeability 45.604 10^-6 cm/s High 0.89
dh-clint Dog hepatocyte intrinsic clearance 76.736 uL/min/10^6 cells High 0.89
dppb Dog plasma protein binding (% unbound) 3.500 % High 0.89
fcs-ppb Fetal calf serum protein binding (% unbound) 6.860 % High 0.89
herg hERG pIC50 4.168 pIC50 High 0.89
hh-clint Human hepatocyte intrinsic clearance 160.694 uL/min/10^6 cells High 0.89
hlm-clint Human liver microsomal intrinsic clearance 73.790 uL/min/mg protein High 0.89
hppb Human plasma protein binding (% unbound) 2.580 % High 0.89
kinase-safety-class ACVR2A,ACVR2B,AURKA,AXL,BRAF,BTK,CAMK2B,CAMK2D,CDK5,CDK9,DDR1,DYRK1B,EIF2AK3,ERBB2,FLT3,GRK2,ITK,JAK2,MAP2K6,MAP3K21,MAP3K7,MAPK10,MAPK7,MAPK9,NTRK2,PDK4,PDPK1,PIK3CB,PIM2,PRKDC,SIK2,SIK3,STK33,TEK,TGFBR1,TTK 36
kinase-selectivity-class ACVR2A,AXL,ERBB2,GRK2 4
mdck-mdr1-efflux MDCK-MDR1 efflux ratio 0.256 High 0.89
mh-clint Mouse hepatocyte intrinsic clearance 564.937 High 0.89
mppb Mouse plasma protein binding (% unbound) 3.780 High 0.89
nih-mdck-mdr1-efflux NIH MDCK-MDR1 efflux ratio 0.097 High 0.89
pfas-class PFAS structural alert (1 = True, 0 = False) 0
pppb Pig plasma protein binding (% unbound) 4.030 % High 0.89
rh-clint Rat hepatocyte intrinsic clearance 169.044 uL/min/10^6 cells High 0.89
rh-fuinc Rat hepatocyte fraction unbound in incubation 54.650 % High 0.89
rppb Rat plasma protein binding (% unbound) 3.740 % High 0.89
solubility-dd Solubility at pH 7.4 in DMSO 75.336 uM High 0.89

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:

SourceCodeDescription
ATC D08AE06 DERMATOLOGICALS
ANTISEPTICS AND DISINFECTANTS
ANTISEPTICS AND DISINFECTANTS
Phenol and derivatives
CHEBI has role CHEBI:78299 environmental food contaminants
CHEBI has role CHEBI:86328 anti-fungal agrichemical

Related Drugs by ATC class:

D08AE Phenol and derivatives 5 drugs

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 9.37 acidic

Orange Book patent data (new drug applications)

None

Orange Book exclusivity data (new drug applications)

None

Bioactivity Summary:

None

External reference:

IDSource
C3652925 UMLSCUI
7017 PUBCHEM_CID
DB13734 DRUGBANK_ID
CHEBI:17043 CHEBI
CH9 PDB_CHEM_ID
0816G78TY1 UNII
5PL687950E UNII
D343Z75HT8 UNII
KFV9K7N7UI UNII

Pharmaceutical products:

None