Basic Information

Drug ID DDPD01435 ...
Drug Name Antipyrine
Molecular Weight 188.2258
Molecular Formula C11H12N2O
CAS Number 60-80-0
SMILES CN1N(C(=O)C=C1C)C1=CC=CC=C1
External Links
DRUGBANK DB01435
PubChem Compound 2206

Experimental Physicochemical Property

Property Name Property Value Unit Raw Value Raw Unit Reference
Caco-2 Permeability -4.55 - -4.55 - ADME Research, USCD
Log P 0.38 - 0.38 - HANSCH,C ET AL. (1995)
Boiling Point 319.0 319 PhysProp
Melting Point 114.0 114 PhysProp
Water Solubility 51900.0 mg/L 51900 mg/L YALKOWSKY,SH & DANNENFELSER,RM 1992)
pKa 1.4 - 1.4 - SANGSTER (1994)

Pharmacokinetic/ Toxicokinetic Property

Property Name Property Value Unit Raw Value Raw Unit Annotation Reference
Clearance 0.0384 L/h/kg 0.64 ml/min/kg intravenous injection, IV; human, homo sapiens; Human Intravenous Pharmacokinetic Dataset
Volume of Distribution 0.77 L/kg 0.77 L/kg intravenous injection, IV; human, homo sapiens; Human Intravenous Pharmacokinetic Dataset
Half-life 12.0 h 12 h intravenous injection, IV; human, homo sapiens; Human Intravenous Pharmacokinetic Dataset

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