2-(2-Amino-5-bromobenzoyl)pyridine

Name: 2-(2-Amino-5-bromobenzoyl)pyridine
SKU: PI1563560
Rating: 5 (1 reviews)

Cat. No.: PI1563560

Product Details Other Identifiers Computed Properties

CAS	1563-56-0
Synonyms	(2-Amino-5-bromophenyl)(pyridin-2-yl)methanone
Purity	98%
Molecular Formula	C12H9BrN2O
Molecular Weight	277.12
Molar Refractivity	66.22

Pubchem ID	73807
InChI Key	KHVZPFKJBLTYCC-UHFFFAOYSA-N
MDL Number	MFCD07780283

Aromatic Heavy Atoms Number	12
BBB Permeant	Yes
Bioavailability Score	0.55
Brenk	1.0 alert
Consensus Log Po/w	2.4
CYP1A2Inhibitor	Yes
CYP2C19Inhibitor	Yes
CYP2C9Inhibitor	No
CYP2D6Inhibitor	No
CYP3A4Inhibitor	No
Egan	0.0
Fraction Csp3	0.0
Ghose	None
GI Absorption	High
Heavy Atom Count	16
Hydrogen Bond Acceptor Count	2.0
Hydrogen Bond Donor Count	1.0
Leadlikeness	0.0
Lipinski	0.0
Log Kp (Skin Permeation)	-5.8 cm/s
Log Po/w (iLOGP)	2.01
Log Po/w (MLOGP)	1.47
Log Po/w (SILICOS-IT)	2.79
Log Po/w (WLOGP)	2.67
Log Po/w (XLOGP3)	3.09
Muegge	0.0
PAINS	1.0 alert
P-gp Substrate	No
Rotatable Bond Count	2
Synthetic Accessibility	1.96
Topological Polar Surface Area	55.98 Å²
Veber	0.0

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