(S)-2-Aminopentan-1-ol

Cat. No.: PI22724818

Product Details Other Identifiers Computed Properties

CAS	22724-81-8
Purity	95%
Molecular Formula	C5H13NO
Linear Formula	HOCH2CH(C3H7)NH2
Molecular Weight	103.16
Molar Refractivity	30.02

Pubchem ID	6951248
InChI Key	ULAXUFGARZZKTK-YFKPBYRVSA-N
MDL Number	MFCD02683229

Hydrogen Bond Donor Count	2.0
Hydrogen Bond Acceptor Count	2.0
Rotatable Bond Count	3
Topological Polar Surface Area	46.25 Å²
Heavy Atom Count	7
Aromatic Heavy Atoms Number	0
Fraction Csp3	1.0
Log Po/w (iLOGP)	1.54
Log Po/w (XLOGP3)	-0.08
Log Po/w (WLOGP)	0.11
Log Po/w (MLOGP)	0.23
Log Po/w (SILICOS-IT)	-0.04
Consensus Log Po/w	0.35
GI Absorption	High
BBB Permeant	No
P-gp Substrate	No
CYP1A2Inhibitor	No
CYP2C19Inhibitor	No
CYP2C9Inhibitor	No
CYP2D6Inhibitor	No
CYP3A4Inhibitor	No
Log Kp (Skin Permeation)	-6.99 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	1.11

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