5-(Hydroxymethyl)oxazolidin-2-one

Cat. No.: PI7517999

Product Details Other Identifiers Computed Properties

CAS	7517-99-9
Purity	97%
Molecular Formula	C4H7NO3
Molecular Weight	117.10
Molar Refractivity	28.78

Pubchem ID	10290773
InChI Key	LSYOFPBORRARMF-UHFFFAOYSA-N
MDL Number	MFCD05721226

Hydrogen Bond Donor Count	2.0
Hydrogen Bond Acceptor Count	3.0
Rotatable Bond Count	1
Topological Polar Surface Area	58.56 Å²
Heavy Atom Count	8
Aromatic Heavy Atoms Number	0
Fraction Csp3	0.75
Log Po/w (iLOGP)	0.53
Log Po/w (XLOGP3)	-0.9
Log Po/w (WLOGP)	-1.29
Log Po/w (MLOGP)	-1.23
Log Po/w (SILICOS-IT)	-0.09
Consensus Log Po/w	-0.6
GI Absorption	High
BBB Permeant	No
P-gp Substrate	No
CYP1A2Inhibitor	No
CYP2C19Inhibitor	No
CYP2C9Inhibitor	No
CYP2D6Inhibitor	No
CYP3A4Inhibitor	No
Log Kp (Skin Permeation)	-7.65 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	2.21

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