4-Benzofurazancarboxaldehyde

Name: 4-Benzofurazancarboxaldehyde
SKU: PI32863324
Rating: 5 (1 reviews)

Cat. No.: PI32863324

Product Details Other Identifiers Computed Properties

CAS	32863-32-4
Purity	98%
Molecular Formula	C7H4N2O2
Molecular Weight	148.12
Molar Refractivity	37.19

Pubchem ID	10290873
InChI Key	YBBRQAXNTWMMFZ-UHFFFAOYSA-N
MDL Number	MFCD07772900

Aromatic Heavy Atoms Number	9
BBB Permeant	Yes
Bioavailability Score	0.55
Brenk	1.0 alert
Consensus Log Po/w	1.03
CYP1A2Inhibitor	Yes
CYP2C19Inhibitor	No
CYP2C9Inhibitor	No
CYP2D6Inhibitor	No
CYP3A4Inhibitor	No
Egan	0.0
Fraction Csp3	0.0
Ghose	None
GI Absorption	High
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	4.0
Hydrogen Bond Donor Count	0.0
Leadlikeness	1.0
Lipinski	0.0
Log Kp (Skin Permeation)	-6.75 cm/s
Log Po/w (iLOGP)	1.53
Log Po/w (MLOGP)	0.39
Log Po/w (SILICOS-IT)	1.55
Log Po/w (WLOGP)	1.04
Log Po/w (XLOGP3)	0.64
Muegge	1.0
PAINS	0.0 alert
P-gp Substrate	No
Rotatable Bond Count	1
Synthetic Accessibility	2.04
Topological Polar Surface Area	55.99 Å²
Veber	0.0

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