(S)-2-(2-Oxopyrrolidin-1-yl)butanoic acid

Name: (S)-2-(2-Oxopyrrolidin-1-yl)butanoic acid
SKU: PI102849490
Rating: 5 (1 reviews)

Cat. No.: PI102849490

Product Details Other Identifiers Computed Properties

CAS	102849-49-0
Purity	97%
Molecular Formula	C8H13NO3
Molecular Weight	171.19
Molar Refractivity	47.24

Pubchem ID	11607993
InChI Key	IODGAONBTQRGGG-LURJTMIESA-N
MDL Number	MFCD08272027

Aromatic Heavy Atoms Number	0
BBB Permeant	No
Bioavailability Score	0.56
Brenk	0.0 alert
Consensus Log Po/w	0.49
CYP1A2Inhibitor	No
CYP2C19Inhibitor	No
CYP2C9Inhibitor	No
CYP2D6Inhibitor	No
CYP3A4Inhibitor	No
Egan	0.0
Fraction Csp3	0.75
Ghose	None
GI Absorption	High
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	3.0
Hydrogen Bond Donor Count	1.0
Leadlikeness	1.0
Lipinski	0.0
Log Kp (Skin Permeation)	-7.12 cm/s
Log Po/w (iLOGP)	1.38
Log Po/w (MLOGP)	0.13
Log Po/w (SILICOS-IT)	0.51
Log Po/w (WLOGP)	0.09
Log Po/w (XLOGP3)	0.31
Muegge	1.0
PAINS	0.0 alert
P-gp Substrate	No
Rotatable Bond Count	3
Synthetic Accessibility	1.82
Topological Polar Surface Area	57.61 Å²
Veber	0.0

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