Basic Information

Drug ID DDPD01353 ...
Drug Name Butobarbital
Molecular Weight 212.2456
Molecular Formula C10H16N2O3
CAS Number 77-28-1
SMILES CCCCC1(CC)C(=O)NC(=O)NC1=O
External Links
DRUGBANK DB01353
T3DB T3D3038
PubChem Compound 6473

Experimental Physicochemical Property

Property Name Property Value Unit Raw Value Raw Unit Reference
Log P 1.73 - 1.73 - HANSCH,C ET AL. (1995)
Melting Point 128.5 128.5 PhysProp
Water Solubility 4880.0 mg/L 4880 mg/L YALKOWSKY,SH & DANNENFELSER,RM 1992)
pKa 7.86 - 7.86 - SANGSTER (1994)
Log S -1.64 - -1.64 - ADME Research, USCD

Pharmacokinetic/ Toxicokinetic Property

Property Name Property Value Unit Raw Value Raw Unit Annotation Reference
Half-life 37.0 h 37 h DRUGBANK
Toxicity LD50 319.6 mg/kg 1.506 mM/kg Intraperitoneal, IP; mouse; T3DB

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