- 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
- Fraction Csp3
- 0.12
- GI absorption
- High
- H-bond acceptors
- 4.0
- H-bond donors
- 0.0
- Heavy atoms
- 13
- LogP
- 2.88
- LogP(Consensus)
- 3.31
- LogP(MLOGP)
- 3.23
- LogP(SILICOS-IT)
- 3.5
- LogP(WLOGP)
- 4.49
- LogP(iLOGP)
- 2.11
- Molar Refractivity
- 43.86
- P-gp substrate
- No
- PSA
- 23.79 Ų
- Rotatable bonds
- 1
- Skin permeation Log K p
- -5.54 cm/s
- Synthetic accessibility
- 1.86
- XLogP3
- 3.22
- 储存条件
- Room temperature
- 外观
- 白色至黄色固体
- 密度
- 1.7±0.1 g/cm³
- 折射率
- 1.517
- 沸点
- 269.3±40.0 °C (760 mmHg)
- 溶解度
- 0.0506 mg/ml ; 0.000202 mol/l
- 熔点
- 50-51 °C
- 精确质量
- 248.940094
- 蒸汽压
- 0.0±0.6 mmHg (25 °C)
- 闪点
- 116.7±27.3 °C
