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

Stem definitionDrug idCAS RN
3212 13425-39-3

Description:

MoleculeDescription

Molfile Inchi Smiles

Synonyms:

  • etofylline nicotinate
  • ethophylline nicotinate
  • hesotanol
  • Molecular weight: 329.32
  • Formula: C15H15N5O4
  • CLOGP: 0.43
  • LIPINSKI: 0
  • HAC: 9
  • HDO: 0
  • TPSA: 97.63
  • ALOGS: -2.01
  • ROTB: 5

Drug dosage:

DoseUnitRoute
0.30 g O

ADMET properties:

PropertyValueReference
BA (Bioavailability) 80 %
BA (Bioavailability) 68 %

Predicted pharmacokinetic/toxicological properties (PK-AZ):

PropertyDescriptionValueUnitConfidenceSimilarity
kinase-safety-class ACVR2A,ACVR2B,AURKA,AXL,BRAF,BTK,CAMK2B,CAMK2D,CDK5,CDK9,DDR1,DYRK1B,EIF2AK3,ERBB2,FLT3,GRK2,GRK3,ITK,JAK1,JAK2,MAP3K21,MAP3K7,MAPK7,MARK4,MTOR,NTRK2,PDK1,PDK2,PIK3CB,PIK3CD,PRKDC,SIK2,SIK3,STK33,TEK,TTK,ULK1 37
kinase-selectivity-class AXL,CDK9,GRK2,IRAK1,MAPK7,PRKDC 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
ATC C04AD04 CARDIOVASCULAR SYSTEM
PERIPHERAL VASODILATORS
PERIPHERAL VASODILATORS
Purine derivatives
MeSH PA D001993 Bronchodilator Agents
MeSH PA D018373 Peripheral Nervous System Agents
MeSH PA D018927 Anti-Asthmatic Agents
MeSH PA D019141 Respiratory System Agents
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

Related Drugs by ATC class:

C04AD Purine derivatives 3 drugs
pentifyllinepentoxifyllinexantinol

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 3.03 Basic
pKa2 1.29 Basic

Orange Book patent data (new drug applications)

None

Orange Book exclusivity data (new drug applications)

None

Bioactivity Summary:

None

External reference:

IDSource
4017661 VANDF
4019440 VANDF
CHEBI:135405 CHEBI
NIO PDB_CHEM_ID
CHEMBL3707239 ChEMBL_ID
DB13842 DRUGBANK_ID
SN6D1V68DL UNII
24611 RXNORM
2275 MMSL
43641 MMSL
5169 MMSL
7161 MMSL
d00314 MMSL
001052 NDDF
005937 NDDF
010920 NDDF
273943001 SNOMEDCT_US
63639004 SNOMEDCT_US
712689006 SNOMEDCT_US
C1612882 UMLSCUI
C0059871 UMLSCUI
C0027996 UMLSCUI
DB00627 DRUGBANK_ID
83435 PUBCHEM_CID
1892 PUBCHEM_CID
938 PUBCHEM_CID
1667 INN_ID
C008749 MESH_SUPPLEMENTAL_RECORD_UI
CHEBI:94764 CHEBI
CHEBI:15940 CHEBI
SN6D1V68DL INXIGHT DRUGS

Pharmaceutical products:

None