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

Stem definitionDrug idCAS RN
4481 537-55-3

Description:

MoleculeDescription

Molfile Inchi Smiles

Synonyms:

  • N-ACETYL-TYROSINE
  • N-Acetyltyrosine
  • N-Acetyl-L-tyrosine
  • Molecular weight: 223.23
  • Formula: C11H13NO4
  • CLOGP: 0.15
  • LIPINSKI: 0
  • HAC: 5
  • HDO: 3
  • TPSA: 86.63
  • ALOGS: -1.95
  • ROTB: 4

Drug dosage:

None

ADMET properties:

None

Predicted pharmacokinetic/toxicological properties (PK-AZ):

PropertyDescriptionValueUnitConfidenceSimilarity
azlogd74 LogD at pH 7.4 -3.190 Moderate 0.65
caco2-efflux Caco-2 efflux ratio (BA/AB) 0.091 Moderate 0.65
caco2-intrinsic-papp Caco-2 intrinsic apparent permeability 0.339 10^-6 cm/s Moderate 0.65
dh-clint Dog hepatocyte intrinsic clearance 1.786 uL/min/10^6 cells Moderate 0.65
dppb Dog plasma protein binding (% unbound) 82.820 % Moderate 0.65
fcs-ppb Fetal calf serum protein binding (% unbound) 70.720 % Moderate 0.65
herg hERG pIC50 4.605 pIC50 Moderate 0.65
hh-clint Human hepatocyte intrinsic clearance 1.774 uL/min/10^6 cells Moderate 0.65
hlm-clint Human liver microsomal intrinsic clearance 3.428 uL/min/mg protein Moderate 0.65
hppb Human plasma protein binding (% unbound) 83.780 % Moderate 0.65
kinase-safety-class ACVR2A,ACVR2B,ACVRL1,ALK,AURKA,AXL,BRAF,BTK,CAMK2B,CAMK2D,CDK4,CDK5,CDK9,DDR1,DYRK1B,EGFR,EIF2AK3,EPHB4,ERBB2,FLT3,GRK2,GRK3,GSK3B,ITK,JAK1,JAK2,JAK3,MAP2K6,MAP3K21,MAP3K7,MAPK12,MAPK7,MAPK9,MAPKAPK2,MTOR,NTRK2,PDK1,PDK2,PDK4,PDPK1,PIK3CB,PIK3CD,PIK3CG,PIM2,PLK1,PRKCD,PRKDC,SIK2,SIK3,STK33,SYK,TEK,TGFBR1,TTK,ULK1,ZAP70 56
kinase-selectivity-class ACVR2B,AXL,BRAF,CDK9,EIF2AK3,EPHB4,GRK2,MAP2K6,MAP3K14,MAPK7,STK33,TEK,TGFBR1 13
mdck-mdr1-efflux MDCK-MDR1 efflux ratio 0.054 Moderate 0.65
mh-clint Mouse hepatocyte intrinsic clearance 0.959 Moderate 0.65
mppb Mouse plasma protein binding (% unbound) 96.300 Moderate 0.65
nih-mdck-mdr1-efflux NIH MDCK-MDR1 efflux ratio 0.100 Moderate 0.65
pfas-class PFAS structural alert (1 = True, 0 = False) 0
pppb Pig plasma protein binding (% unbound) 73.050 % Moderate 0.65
rh-clint Rat hepatocyte intrinsic clearance 0.693 uL/min/10^6 cells Moderate 0.65
rh-fuinc Rat hepatocyte fraction unbound in incubation 89.870 % Moderate 0.65
rppb Rat plasma protein binding (% unbound) 81.120 % Moderate 0.65
solubility-dd Solubility at pH 7.4 in DMSO 877.001 uM Moderate 0.65

Approvals:

DateAgencyCompanyOrphan
None FDA

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
CHEBI has role CHEBI:59163 biomarker
CHEBI has role CHEBI:71178 EC 2.1.1.4 (acetylserotonin <em>O</em>-methyltransferase) inhibitor
CHEBI has role CHEBI:84087 human urinary metabolite

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

DiseaseRelationSNOMED_IDDOID
Nutritional support indication 278906000




🐶 Veterinary Drug Use

None

🐶 Veterinary products

None

Acid dissociation constants calculated using MoKa v3.0.0

Dissociation levelDissociation constantType (acidic/basic)
pKa1 3.67 acidic
pKa2 10.31 acidic
pKa3 13.34 acidic

Orange Book patent data (new drug applications)

None

Orange Book exclusivity data (new drug applications)

None

Bioactivity Summary:

None

External reference:

IDSource
4037132 VANDF
3NF PDB_CHEM_ID
C025787 MESH_SUPPLEMENTAL_RECORD_UI
DB11102 DRUGBANK_ID
31005 RXNORM
012368 NDDF
C0067794 UMLSCUI
68310 PUBCHEM_CID
DA8G610ZO5 UNII

Pharmaceutical products:

None