- Aromatic heavy atoms
- 6
- BBB permeant
- Yes
- Bioavailability Score
- 0.55
- CYP1A2 inhibitor
- Yes
- CYP2C19 inhibitor
- No
- CYP2C9 inhibitor
- No
- CYP2D6 inhibitor
- No
- CYP3A4 inhibitor
- No
- GI absorption
- High
- Heavy atoms
- 11
- Hydrogen bond acceptors
- 2.0
- Hydrogen bond donors
- 0.0
- Log S (Ali)
- -2.5
- Log S (ESOL)
- -2.81
- Log S (SILICOS-IT)
- -3.79
- LogP
- 2.78710
- Molar refractivity
- 45.56
- P-gp substrate
- No
- PSA
- 22.12 Ų
- Rotatable bonds
- 2
- Skin permeation coefficient (Log K p)
- -5.77 cm/s
- Solubility
- 0.299 mg/ml ; 0.00156 mol/l
- Storage conditions
- 2-8°C，保存于惰性气体中
- 密度
- 1.305±0.06 g/cm³ (Predicted)
- 沸点
- 269.9±35.0 °C (Predicted)
- 精确质量
- 190.99000
- 酸度系数(pKa)
- -0.91±0.10 (Predicted)
