(S)-3-Hydroxypyrrolidine hydrochloride

Cat. No.: PI122536941

Product Details Other Identifiers Computed Properties

CAS	122536-94-1
Purity	97%
Molecular Formula	C4H10ClNO
Molecular Weight	123.58
Molar Refractivity	34.07

Pubchem ID	22309122
InChI Key	QPMSJEFZULFYTB-WCCKRBBISA-N
MDL Number	MFCD00272298

Hydrogen Bond Donor Count	2.0
Hydrogen Bond Acceptor Count	2.0
Rotatable Bond Count	0
Topological Polar Surface Area	32.26 Å²
Heavy Atom Count	7
Aromatic Heavy Atoms Number	0
Fraction Csp3	1.0
Log Po/w (iLOGP)	0.0
Log Po/w (XLOGP3)	0.11
Log Po/w (WLOGP)	-0.24
Log Po/w (MLOGP)	-0.16
Log Po/w (SILICOS-IT)	0.52
Consensus Log Po/w	0.05
GI Absorption	High
BBB Permeant	No
P-gp Substrate	No
CYP1A2Inhibitor	No
CYP2C19Inhibitor	No
CYP2C9Inhibitor	No
CYP2D6Inhibitor	No
CYP3A4Inhibitor	No
Log Kp (Skin Permeation)	-6.98 cm/s
Lipinski	0.0
Ghose	None
Veber	0.0
Egan	0.0
Muegge	2.0
Bioavailability Score	0.55
PAINS	0.0 alert
Brenk	0.0 alert
Leadlikeness	1.0
Synthetic Accessibility	1.37

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