1-Cyclohexylpiperazine

1-Cyclohexylpiperazine

Cat. No.: PI17766288

Product Details Other Identifiers Computed Properties
CAS 17766-28-8
Purity 98%
Molecular Formula C10H20N2
Molecular Weight 168.28
Molar Refractivity 59.48
Pubchem ID 87298
InChI Key XPDSXKIDJNKIQY-UHFFFAOYSA-N
MDL Number MFCD00044809
Hydrogen Bond Donor Count 1.0
Hydrogen Bond Acceptor Count 2.0
Rotatable Bond Count 1
Topological Polar Surface Area 15.27 Ų
Heavy Atom Count 12
Aromatic Heavy Atoms Number 0
Fraction Csp3 1.0
Log Po/w (iLOGP) 2.42
Log Po/w (XLOGP3) 1.08
Log Po/w (WLOGP) 0.46
Log Po/w (MLOGP) 1.52
Log Po/w (SILICOS-IT) 1.81
Consensus Log Po/w 1.46
GI Absorption Low
BBB Permeant No
P-gp Substrate Yes
CYP1A2Inhibitor No
CYP2C19Inhibitor No
CYP2C9Inhibitor No
CYP2D6Inhibitor No
CYP3A4Inhibitor No
Log Kp (Skin Permeation) -6.56 cm/s
Lipinski 0.0
Ghose None
Veber 0.0
Egan 0.0
Muegge 1.0
Bioavailability Score 0.55
PAINS 0.0 alert
Brenk 0.0 alert
Leadlikeness 1.0
Synthetic Accessibility 1.59

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