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

Basic Information

Drug ID DDPD00812 ...
Drug Name Phenylbutazone
Molecular Weight 308.3743
Molecular Formula C19H20N2O2
CAS Number 50-33-9
SMILES CCCCC1C(=O)N(N(C1=O)C1=CC=CC=C1)C1=CC=CC=C1
External Links
DRUGBANK DB00812
PubChem Compound 4781

Experimental Physicochemical Property

Property Name Property Value Unit Raw Value Raw Unit Reference
Log P 3.16 - 3.16 - SANGSTER (1994)
Melting Point 105.0 ℃ 105 ℃ PhysProp
Water Solubility 47.5 mg/L 47.5 mg/L YALKOWSKY,SH & DANNENFELSER,RM 1992)
pKa 4.5 - 4.5 - SERJEANT,EP & DEMPSEY,B (1979)
Log S -3.81 - -3.81 - ADME Research, USCD

Pharmacokinetic/ Toxicokinetic Property

Property Name Property Value Unit Raw Value Raw Unit Annotation Reference
Toxicity LD50 238.0 mg/kg 238.0 mg/kg PO, oral; mouse; DRUGBANK
Toxicity LD50 781.0 mg/kg 781.0 mg/kg PO, oral; rabbit; DRUGBANK
Toxicity LD50 245.0 mg/kg 245.0 mg/kg PO, oral; Rattus, Rat; DRUGBANK
Toxicity LD50 375.0 mg/kg 375.0 mg/kg PO, oral; Rattus, Rat; 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