Basic Information

Drug ID DDPD13882 ...
Drug Name Methyl nicotinate
Molecular Weight 137.136
Molecular Formula C7H7NO2
CAS Number 93-60-7
SMILES COC(=O)C1=CN=CC=C1
External Links
DRUGBANK DB13882
PubChem Compound 7151

Experimental Physicochemical Property

Property Name Property Value Unit Raw Value Raw Unit Reference
Log P 0.8 - 0.8 - Norwegian Food Safety Authority Methyl Nicotinate (MN) Risk Profile
Boiling Point 209.0 209 MSDS
Melting Point 40.5 38-43 MSDS

Pharmacokinetic/ Toxicokinetic Property

Property Name Property Value Unit Raw Value Raw Unit Annotation Reference
Absorption 85.0 % 80-90 % skin/dermal; DRUGBANK
Half-life 0.11 h 3-10 min high protein binding; DRUGBANK
Toxicity LD50 1680.0 mg/kg 1.68 g/kg subcutaneous injection, SC; Rattus, Rat; DRUGBANK
Toxicity LD50 5000.0 mg/kg 5.0 g/kg subcutaneous injection, SC; Rattus, Rat; DRUGBANK
Eliminate Route 15.0 % ~15 % Urinary excretion; human, homo sapiens; DRUGBANK

Maximum Dosage

Not Available

Drug Property Radar Chart

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Note: Center: Q1-1.5*IQR, Edge: Q3+1.5*IQR; Q1: Quantile 1, Q3: Quantile 3, IQR: Q3-Q1