- BBB permeant
- Yes
- Bioavailability Score
- 0.55
- Brenk
- 0.0
- CYP1A2 inhibitor
- No
- CYP2C19 inhibitor
- No
- CYP2C9 inhibitor
- No
- CYP2D6 inhibitor
- No
- CYP3A4 inhibitor
- No
- Consensus Log P o/w
- 0.72
- Egan
- 0.0
- Fraction Csp3
- 0.0
- GI absorption
- High
- Ghose
- None
- Leadlikeness
- 1.0
- Lipinski
- 0.0
- Log K p (skin permeation)
- -6.59 cm/s
- Log S (Ali)
- -1.41
- Log S (ESOL)
- -1.7
- Log S (SILICOS-IT)
- -2.33
- LogP
- 0.87
- MLOGP
- -0.84
- Molar Refractivity
- 31.76
- Muegge
- 1.0
- Num. H-bond acceptors
- 3.0
- Num. H-bond donors
- 0.0
- Num. arom. heavy atoms
- 6
- Num. heavy atoms
- 9
- Num. rotatable bonds
- 0
- P-gp substrate
- No
- PAINS
- 0.0 alert
- PSA
- 49.57 Ų
- SILICOS-IT LogP
- 1.54
- Solubility
- 2.81 mg/ml ; 0.0201 mol/l
- Synthetic accessibility
- 2.06
- Veber
- 0.0
- WLOGP
- 1.0
- XLogP3
- 0.79
- iLOGP
- 1.08
- 储存
- 室温
- 密度
- 1.4±0.1 g/cm³
- 形态
- 固体
- 折射率
- 1.568
- 沸点
- 229.4±35.0 °C (760 mmHg)
- 熔点
- 24-26 °C
- 精确质量
- 138.993729
- 蒸汽压
- 0.1±0.5 mmHg (25 °C)
- 酸度系数(pKa)
- -3.99±0.10 (Predicted)
- 闪点
- 92.5±25.9 °C
- 颜色
- 米白色
