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

Basic Information

Drug ID DDPD00655 ...
Drug Name Estrone
Molecular Weight 270.3661
Molecular Formula C18H22O2
CAS Number 53-16-7
SMILES [H][C@@]12CCC(=O)[C@@]1(C)CC[C@]1([H])C3=C(CC[C@@]21[H])C=C(O)C=C3
External Links
DRUGBANK DB00655
T3DB T3D4746
PubChem Compound 5870

Experimental Physicochemical Property

Property Name Property Value Unit Raw Value Raw Unit Reference
Log P 2.6 - 2.6 - 'MSDS'
Boiling Point 445.2 ℃ 445.2 ℃ 'MSDS'
Melting Point 259.5 ℃ 258-261 ℃ 'MSDS'
Water Solubility 760.0 mg/L 0.76 g/L 'MSDS'
Log S -3.96 - -3.96 - ADME Research, USCD

Pharmacokinetic/ Toxicokinetic Property

Property Name Property Value Unit Raw Value Raw Unit Annotation Reference
Absorption 43.0 % 43 % DRUGBANK
Half-life 19.0 h 19 h DRUGBANK
Protein Binding 95.0 % >95 % 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