Basic Information

Drug ID DDPD06154 ...
Drug Name Pentaerythritol tetranitrate
Molecular Weight 316.1366
Molecular Formula C5H8N4O12
CAS Number 78-11-5
SMILES [O-][N+](=O)OCC(CO[N+]([O-])=O)(CO[N+]([O-])=O)CO[N+]([O-])=O
External Links
DRUGBANK DB06154
PubChem Compound 6518

Experimental Physicochemical Property

Property Name Property Value Unit Raw Value Raw Unit Reference
Melting Point 140.0 140 MSDS
Water Solubility 133.0 mg/L 0.133 mg/ml L2402

Pharmacokinetic/ Toxicokinetic Property

Property Name Property Value Unit Raw Value Raw Unit Annotation Reference
Clearance 36.6 L/h/kg 0.61±0.16 L/min/kg DRUGBANK
Volume of Distribution 4.2 L/kg 4.2±1.1 L/kg Steady state volume of distribution; Rattus, Rat; DRUGBANK
Half-life 4.5 h 4-5 h elimination half-life; PO, oral; Male, men; DRUGBANK
Toxicity LD50 25000.0 mg/kg 25000.0 mg/kg PO, oral; mouse; 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