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

Stem definitionDrug idCAS RN
2689 43119-47-7

Description:

MoleculeDescription

Molfile Inchi Smiles

Synonyms:

  • tocopherol nicotinate
  • tocopheryl nicotinate
  • Vitamin E nicotinate
  • alpha-Tocopherol nicotinate
  • Molecular weight: 535.81
  • Formula: C35H53NO3
  • CLOGP: 12
  • LIPINSKI: 2
  • HAC: 4
  • HDO: 0
  • TPSA: 48.42
  • ALOGS: -8.40
  • ROTB: 15

Drug dosage:

None

ADMET properties:

PropertyValueReference
BA (Bioavailability) 68 %

Predicted pharmacokinetic/toxicological properties (PK-AZ):

PropertyDescriptionValueUnitConfidenceSimilarity
kinase-safety-class ACVR2A,ACVR2B,AXL,BRAF,BTK,CAMK2B,CAMK2D,CDK5,CDK9,DYRK1B,EIF2AK3,EPHB4,ERBB2,GRK2,ITK,JAK2,MAP2K6,MAP3K7,MAPK10,MAPK7,MAPKAPK2,MET,NTRK2,PDK2,PDK4,PDPK1,PIK3CA,PIK3CB,PIK3CG,PIM2,PRKDC,STK33,TEK,TGFBR1,TTK 35
kinase-selectivity-class AXL,BRAF,EIF2AK3,EPHB4,GRK2,PDK4 6
pfas-class PFAS structural alert (1 = True, 0 = False) 0

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
CHEBI has role CHEBI:25212 metabolite
CHEBI has role CHEBI:33231 antitubercular agent
CHEBI has role CHEBI:35469 antidepressant
CHEBI has role CHEBI:35474 anxiolytic drug
CHEBI has role CHEBI:35476 antipsychotic agent
CHEBI has role CHEBI:35480 analgesic
CHEBI has role CHEBI:35526 hypoglycemic agent
CHEBI has role CHEBI:35554 cardiovascular drug
CHEBI has role CHEBI:35610 antineoplastic agent
CHEBI has role CHEBI:35620 vasodilator agent
CHEBI has role CHEBI:35679 antilipemic drug
CHEBI has role CHEBI:35821 anticholesteremic drug
CHEBI has role CHEBI:50247 antidote
CHEBI has role CHEBI:64946 anti-HIV agent
CHEBI has role CHEBI:74518 anti-obesity agent
CHEBI has role CHEBI:75771 mouse metabolite
CHEBI has role CHEBI:75835 anti-anaemic agent
CHEBI has role CHEBI:76924 plant metabolite
CHEBI has role CHEBI:76971 <em>Escherichia coli</em> metabolite
CHEBI has role CHEBI:84087 human urinary metabolite
CHEBI has role CHEBI:84264 EC 3.5.1.19 (nicotinamidase) inhibitor
CHEBI has role CHEBI:145947 antiatherosclerotic agent
CHEBI has role CHEBI:231911 renoprotective agent
CHEBI has role CHEBI:38068 antimalarial

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 2.88 Basic

Orange Book patent data (new drug applications)

None

Orange Book exclusivity data (new drug applications)

None

Bioactivity Summary:

None

External reference:

IDSource
D01530 KEGG_DRUG
4017661 VANDF
4019440 VANDF
C3505684 UMLSCUI
CHEBI:32239 CHEBI
NIO PDB_CHEM_ID
DB15921 DRUGBANK_ID
C012581 MESH_SUPPLEMENTAL_RECORD_UI
WI1J5UCY5C UNII
27990 PUBCHEM_CID
1359091 RXNORM
2275 MMSL
43641 MMSL
5169 MMSL
7161 MMSL
d00314 MMSL
001052 NDDF
009945 NDDF
16132211000001106 SNOMEDCT_US
273943001 SNOMEDCT_US
63639004 SNOMEDCT_US
C0606070 UMLSCUI
C0027996 UMLSCUI
DB11635 DRUGBANK_ID
DB00627 DRUGBANK_ID
938 PUBCHEM_CID
CHEBI:753119 CHEBI
CHEBI:15940 CHEBI

Pharmaceutical products:

None