Basic Information Experimental Physicochemical Property Pharmacokinetic/Toxicokinetic Property Maximum Dosage Drug Property Radar Chart

Basic Information

Drug ID DDPD01154 ...
Drug Name Thiamylal
Molecular Weight 254.349
Molecular Formula C12H18N2O2S
CAS Number 77-27-0
SMILES CCCC(C)C1(CC=C)C(=O)NC(=S)NC1=O
External Links
DRUGBANK DB01154
PubChem Compound 3032285

Experimental Physicochemical Property

Property Name Property Value Unit Raw Value Raw Unit Reference
Log P 3.23 - 3.23 - HANSCH,C ET AL. (1995)
Melting Point 132.5 ℃ 132-133 ℃ PhysProp
Water Solubility 49.4 mg/L 49.4 mg/L YALKOWSKY,SH & DANNENFELSER,RM 1992)
pKa 7.48 - 7.48 - SANGSTER (1994)
Log S -3.46 - -3.46 - ADME Research, USCD

Pharmacokinetic/ Toxicokinetic Property

Property Name Property Value Unit Raw Value Raw Unit Annotation Reference
Half-life 14.3 h 14.3 h cat; DRUGBANK
Toxicity LD50 51.0 mg/kg 51.0 mg/kg intravenous injection, IV; 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