3-(Cyclopropylmethoxy)-4-hydroxybenzoic acid

Name: 3-(Cyclopropylmethoxy)-4-hydroxybenzoic acid
SKU: PI1243391447
Rating: 5 (1 reviews)

Cat. No.: PI1243391447

Product Details Other Identifiers Computed Properties

CAS	1243391-44-7
Purity	97%
Molecular Formula	C11H12O4
Molecular Weight	208.21
Molar Refractivity	54.22

Pubchem ID	69648375
InChI Key	CPGNRCZMIIWDPZ-UHFFFAOYSA-N
MDL Number	MFCD16999961

Aromatic Heavy Atoms Number	6
BBB Permeant	Yes
Bioavailability Score	0.56
Brenk	0.0 alert
Consensus Log Po/w	1.77
CYP1A2Inhibitor	Yes
CYP2C19Inhibitor	No
CYP2C9Inhibitor	No
CYP2D6Inhibitor	No
CYP3A4Inhibitor	No
Egan	0.0
Fraction Csp3	0.36
Ghose	None
GI Absorption	High
Heavy Atom Count	15
Hydrogen Bond Acceptor Count	4.0
Hydrogen Bond Donor Count	2.0
Leadlikeness	1.0
Lipinski	0.0
Log Kp (Skin Permeation)	-6.02 cm/s
Log Po/w (iLOGP)	1.95
Log Po/w (MLOGP)	1.26
Log Po/w (SILICOS-IT)	1.64
Log Po/w (WLOGP)	1.82
Log Po/w (XLOGP3)	2.18
Muegge	0.0
PAINS	0.0 alert
P-gp Substrate	No
Rotatable Bond Count	4
Synthetic Accessibility	1.85
Topological Polar Surface Area	66.76 Å²
Veber	0.0

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