Tetra-O-acetyl-β-D-ribofuranose

Cat. No.: PI13035615

Product Details Other Identifiers Computed Properties

CAS	13035-61-5
Synonyms	(2S,3R,4R,5R)-5-(Acetoxymethyl)tetrahydrofuran-2,3,4-triyl triacetate
Purity	97%
Molecular Formula	C13H18O9
Linear Formula	C5H10O5(C2H2O)4
Molecular Weight	318.28
Molar Refractivity	68.72

Pubchem ID	83064
InChI Key	IHNHAHWGVLXCCI-FDYHWXHSSA-N
MDL Number	MFCD00005358

Hydrogen Bond Donor Count	0.0
Hydrogen Bond Acceptor Count	9.0
Rotatable Bond Count	9
Topological Polar Surface Area	114.43 Å²
Heavy Atom Count	22
Aromatic Heavy Atoms Number	0
Fraction Csp3	0.69
Log Po/w (iLOGP)	2.86
Log Po/w (XLOGP3)	0.67
Log Po/w (WLOGP)	-0.3
Log Po/w (MLOGP)	-0.57
Log Po/w (SILICOS-IT)	0.09
Consensus Log Po/w	0.55
GI Absorption	High
BBB Permeant	No
P-gp Substrate	No
CYP1A2Inhibitor	No
CYP2C19Inhibitor	No
CYP2C9Inhibitor	No
CYP2D6Inhibitor	No
CYP3A4Inhibitor	No
Log Kp (Skin Permeation)	-7.77 cm/s
Lipinski	0.0
Ghose	None
Veber	0.0
Egan	0.0
Muegge	0.0
Bioavailability Score	0.55
PAINS	0.0 alert
Brenk	1.0 alert
Leadlikeness	1.0
Synthetic Accessibility	4.29

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