N-Sar-OMe·HCl

N-Sar-OMe·HCl

Cat. No.: PI13515930

Product Details Other Identifiers Computed Properties
CAS 13515-93-0
Synonyms Methyl N-methylglycinate hydrochloride
Purity 97%
Molecular Formula C4H10ClNO2
Molecular Weight 139.58
Molar Refractivity 32.39
Pubchem ID 83544
InChI Key HQZMRJBVCVYVQA-UHFFFAOYSA-N
MDL Number MFCD00038876
Hydrogen Bond Donor Count 1.0
Hydrogen Bond Acceptor Count 3.0
Rotatable Bond Count 3
Topological Polar Surface Area 38.33 Ų
Heavy Atom Count 8
Aromatic Heavy Atoms Number 0
Fraction Csp3 0.75
Log Po/w (iLOGP) 0.0
Log Po/w (XLOGP3) 0.52
Log Po/w (WLOGP) 0.18
Log Po/w (MLOGP) 0.01
Log Po/w (SILICOS-IT) -0.35
Consensus Log Po/w 0.07
GI Absorption High
BBB Permeant No
P-gp Substrate No
CYP1A2Inhibitor No
CYP2C19Inhibitor No
CYP2C9Inhibitor No
CYP2D6Inhibitor No
CYP3A4Inhibitor No
Log Kp (Skin Permeation) -6.78 cm/s
Lipinski 0.0
Ghose None
Veber 0.0
Egan 0.0
Muegge 2.0
Bioavailability Score 0.55
PAINS 0.0 alert
Brenk 0.0 alert
Leadlikeness 1.0
Synthetic Accessibility 1.03

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