3-(Dimethylamino)-1-(6-(trifluoromethyl)pyridin-3-yl)prop-2-en-1-one

• Catalog: OFC1015078440-1
• CAS: 1015078-44-0
• Category: Fluoroalkenes
• Purity: 97%
• MDL Number: MFCD12401613

• Molecular Formula: C11H11F3N2O
• Molecular Weight: 244.21
• Molar Refractivity: 56.28

• Bioavailability Score: 0.55
• Egan: 0.0
• Ghose: None
• Lipinski: 0.0
• Muegge: 0.0
• Veber: 0.0
• Consensus LogP: 2.19
• MLogP: 1.09
• SILICOS-IT: 2.39
• WLogP: 3.51
• XLogP3: 1.82
• iLogP: 2.14
• BBB Permeant: Yes
• CYP1A2 Inhibitor: Yes
• CYP2C19 Inhibitor: Yes
• CYP2C9 Inhibitor: No
• CYP2D6 Inhibitor: No
• CYP3A4 Inhibitor: No
• GI Absorption: High
• LogKp: -6.5 cm/s
• P-gp Substrate: No
• Fraction Csp3: 0.27