- BBB permeant
- Yes
- Bioavailability Score
- 0.55
- Brenk
- 0.0 alert
- CYP1A2 inhibitor
- Yes
- CYP2C19 inhibitor
- No
- CYP2C9 inhibitor
- No
- CYP2D6 inhibitor
- No
- CYP3A4 inhibitor
- No
- Consensus Log P o/w
- 1.91
- Egan
- 0.0
- Fraction Csp3
- 0.4
- GI absorption
- High
- Ghose
- None
- Leadlikeness
- 1.0
- Lipinski
- 0.0
- Log K p (skin permeation)
- -6.08 cm/s
- Log P o/w (MLOGP)
- 1.83
- Log P o/w (SILICOS-IT)
- 1.95
- Log P o/w (WLOGP)
- 1.78
- Log P o/w (XLOGP3)
- 1.73
- Log P o/w (iLOGP)
- 2.26
- Log S (Ali)
- -2.09
- Log S (ESOL)
- -2.13
- Log S (SILICOS-IT)
- -3.0
- LogP
- 1.88
- Molar Refractivity
- 50.22
- Muegge
- 1.0
- Num. H-bond acceptors
- 2.0
- Num. H-bond donors
- 1.0
- Num. arom. heavy atoms
- 6
- Num. heavy atoms
- 12
- Num. rotatable bonds
- 3
- P-gp substrate
- No
- PAINS
- 0.0 alert
- PSA
- 35.25000
- Solubility
- 1.24 mg/ml ; 0.00748 mol/l
- Synthetic accessibility
- 1.0
- TPSA
- 35.25
Ų
- Veber
- 0.0
- 储存条件
- 室温，密闭，干燥
- 密度
- 1.0±0.1 g/cm3
- 折射率
- 1.519
- 沸点
- 259.2±15.0 °C at 760 mmHg
- 精确质量
- 165.115356
- 蒸汽压
- 0.0±0.5 mmHg at 25°C
- 闪点
- 108.3±13.6 °C
