Isopropylhydrazine hydrochloride

Cat. No.: PI16726413

Product Details Other Identifiers Computed Properties

CAS	16726-41-3
Purity	97%
Molecular Formula	C3H11ClN2
Molecular Weight	110.59
Molar Refractivity	27.9

Pubchem ID	85573
InChI Key	ILULYDJFTJKQAP-UHFFFAOYSA-N
MDL Number	MFCD01746887

Hydrogen Bond Donor Count	2.0
Hydrogen Bond Acceptor Count	2.0
Rotatable Bond Count	1
Topological Polar Surface Area	38.05 Å²
Heavy Atom Count	6
Aromatic Heavy Atoms Number	0
Fraction Csp3	1.0
Log Po/w (iLOGP)	0.0
Log Po/w (XLOGP3)	0.65
Log Po/w (WLOGP)	-3.03
Log Po/w (MLOGP)	0.63
Log Po/w (SILICOS-IT)	-0.95
Consensus Log Po/w	-0.54
GI Absorption	Low
BBB Permeant	No
P-gp Substrate	No
CYP1A2Inhibitor	No
CYP2C19Inhibitor	No
CYP2C9Inhibitor	No
CYP2D6Inhibitor	No
CYP3A4Inhibitor	No
Log Kp (Skin Permeation)	-6.51 cm/s
Lipinski	0.0
Ghose	None
Veber	0.0
Egan	0.0
Muegge	2.0
Bioavailability Score	0.56
PAINS	0.0 alert
Brenk	1.0 alert
Leadlikeness	1.0
Synthetic Accessibility	1.33

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