Boc-Arg-OH·HCl·H₂O

Name: Boc-Arg-OH·HCl·H₂O
SKU: PI114622810
Rating: 5 (1 reviews)

Cat. No.: PI114622810

Product Details Other Identifiers Computed Properties

CAS	114622-81-0
Synonyms	N2-Boc-L-arginine Hydrochloride Hydrate
Purity	98%
Molecular Formula	C11H25ClN4O5
Molecular Weight	328.79
Molar Refractivity	80.39

Pubchem ID	2729004
InChI Key	OVXLPYFDJUFEHQ-KLXURFKVSA-N
MDL Number	MFCD00065552

Hydrogen Bond Donor Count	6.0
Hydrogen Bond Acceptor Count	6.0
Rotatable Bond Count	10
Topological Polar Surface Area	146.76 Å²
Heavy Atom Count	21
Aromatic Heavy Atoms Number	0
Fraction Csp3	0.73
Log Po/w (iLOGP)	0.0
Log Po/w (XLOGP3)	-0.47
Log Po/w (WLOGP)	0.97
Log Po/w (MLOGP)	-0.35
Log Po/w (SILICOS-IT)	-0.68
Consensus Log Po/w	-0.11
GI Absorption	Low
BBB Permeant	No
P-gp Substrate	No
CYP1A2Inhibitor	No
CYP2C19Inhibitor	No
CYP2C9Inhibitor	No
CYP2D6Inhibitor	No
CYP3A4Inhibitor	No
Log Kp (Skin Permeation)	-8.64 cm/s
Lipinski	1.0
Ghose	None
Veber	1.0
Egan	1.0
Muegge	1.0
Bioavailability Score	0.55
PAINS	0.0 alert
Brenk	2.0 alert
Leadlikeness	1.0
Synthetic Accessibility	3.29

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