Basic Information

Drug ID DDPD06755 ...
Drug Name Beta carotene
Molecular Weight 536.888
Molecular Formula C40H56
CAS Number 7235-40-7
SMILES C\C(\C=C\C=C(/C)\C=C\C1=C(C)CCCC1(C)C)=C/C=C/C=C(\C)/C=C/C=C(\C)/C=C/C1=C(C)CCCC1(C)C
External Links
DRUGBANK DB06755
PubChem Compound 5280489

Experimental Physicochemical Property

Property Name Property Value Unit Raw Value Raw Unit Reference
Log P 17.62 - 17.62 - US EPA
Boiling Point 605.0 633-577 UCSD
Melting Point 180.0 176-184 'MSDS'
Water Solubility 0.6 mg/L 0.0006 g/l 'MSDS'

Pharmacokinetic/ Toxicokinetic Property

Property Name Property Value Unit Raw Value Raw Unit Annotation Reference
AUC 26.3 ng.h/ml 26.3 mcg.h/L Oral single dose; DRUGBANK
C Max 0.58 ng/ml 0.58 mcg/L Oral single dose; DRUGBANK
T Max 6.0 h 6 h Oral single dose; DRUGBANK
Clearance 0.000365 mg/L/h 0.68 nmol/L/h PO, oral; DRUGBANK
Half-life 180.0 h 4-11 day DRUGBANK
Toxicity LD50 5000.0 mg/kg >5000 mg/kg 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