3-Morpholino-5,6-dihydropyridin-2(1H)-one

Name: 3-Morpholino-5,6-dihydropyridin-2(1H)-one
SKU: PI545445407
Rating: 5 (1 reviews)

Cat. No.: PI545445407

Product Details Other Identifiers Computed Properties

CAS	545445-40-7
Purity	95%
Molecular Formula	C9H14N2O2
Molecular Weight	182.22
Molar Refractivity	55.49

Pubchem ID	21891460
InChI Key	SRICXDSOENVWEU-UHFFFAOYSA-N
MDL Number	MFCD18072442

Hydrogen Bond Donor Count	1.0
Hydrogen Bond Acceptor Count	2.0
Rotatable Bond Count	1
Topological Polar Surface Area	41.57 Å²
Heavy Atom Count	13
Aromatic Heavy Atoms Number	0
Fraction Csp3	0.67
Log Po/w (iLOGP)	1.75
Log Po/w (XLOGP3)	0.06
Log Po/w (WLOGP)	-1.04
Log Po/w (MLOGP)	-0.36
Log Po/w (SILICOS-IT)	0.84
Consensus Log Po/w	0.25
GI Absorption	High
BBB Permeant	No
P-gp Substrate	No
CYP1A2Inhibitor	No
CYP2C19Inhibitor	No
CYP2C9Inhibitor	No
CYP2D6Inhibitor	No
CYP3A4Inhibitor	No
Log Kp (Skin Permeation)	-7.37 cm/s
Lipinski	0.0
Ghose	None
Veber	0.0
Egan	0.0
Muegge	1.0
Bioavailability Score	0.55
PAINS	0.0 alert
Brenk	0.0 alert
Leadlikeness	1.0
Synthetic Accessibility	2.91

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