- Aromatic heavy atoms
- 6
- BBB permeant
- Yes
- Bioavailability Score
- 0.55
- Brenk alert
- 2.0
- CYP1A2 inhibitor
- Yes
- CYP2C19 inhibitor
- No
- CYP2C9 inhibitor
- No
- CYP2D6 inhibitor
- No
- CYP3A4 inhibitor
- No
- Egan
- 0.0
- Fraction Csp3
- 0.29
- GI absorption
- High
- Ghose
- None
- H-bond acceptors
- 1.0
- H-bond donors
- 0.0
- Heavy atoms
- 10
- Leadlikeness
- 0.0
- Lipinski
- 0.0
- LogP
- 2.69
- LogS
- -2.77 (Ali)
- Molar Refractivity
- 49.74
- Muegge
- 1.0
- P-gp substrate
- No
- PAINS alert
- 0.0
- PSA
- 12.89 Ų
- Rotatable bonds
- 1
- Skin permeation coefficient (Log K p)
- -5.9 cm/s
- Synthetic accessibility
- 2.25
- Veber
- 0.0
- 储存条件
- 2-8°C
- 密度
- 1.8±0.1 g/cm³
- 折射率
- 1.601
- 沸点
- 294.5±35.0 °C (760 mmHg)
- 溶解度
- 0.0593 mg/ml ; 0.000224 mol/l
- 精确质量
- 262.894501
- 蒸汽压
- 0.0±0.6 mmHg (25 °C)
- 酸度系数(pKa)
- 0.61±0.10 (Predicted)
- 闪点
- 131.9±25.9 °C
