Cyclohexylhydrazine hydrochloride

Introduction

CAS No. :	24214-73-1	MDL No. :	MFCD00060160
Formula :	C6H15ClN2	Boiling Point :	No data available
Linear Structure Formula :	NHNH2C6H11·HCl	InChI Key :	JZRHODNPRNTXKO-UHFFFAOYSA-N
M.W :	150.65	Pubchem ID :	207836
Synonyms :

Physicochemical Properties

Num. heavy atoms :	9
Num. arom. heavy atoms :	0
Fraction Csp3 :	1.0
Num. rotatable bonds :	1
Num. H-bond acceptors :	2.0
Num. H-bond donors :	2.0
Molar Refractivity :	41.32
TPSA :	38.05 Ų

Pharmacokinetics

GI absorption :	High
BBB permeant :	Yes
P-gp substrate :	No
CYP1A2 inhibitor :	No
CYP2C19 inhibitor :	No
CYP2C9 inhibitor :	No
CYP2D6 inhibitor :	No
CYP3A4 inhibitor :	No
Log Kp (skin permeation) :	-6.04 cm/s

Lipophilicity

Log Po/w (iLOGP) :	0.0
Log Po/w (XLOGP3) :	1.66
Log Po/w (WLOGP) :	1.58
Log Po/w (MLOGP) :	1.38
Log Po/w (SILICOS-IT) :	0.5
Consensus Log Po/w :	1.03

Druglikeness

Lipinski :	0.0
Ghose :	None
Veber :	0.0
Egan :	0.0
Muegge :	1.0
Bioavailability Score :	0.55

Water Solubility

Log S (ESOL) :	-1.75
Solubility :	2.66 mg/ml ; 0.0176 mol/l
Class :	Very soluble
Log S (Ali) :	-2.07
Solubility :	1.27 mg/ml ; 0.00846 mol/l
Class :	Soluble
Log S (SILICOS-IT) :	-0.95
Solubility :	16.8 mg/ml ; 0.112 mol/l
Class :	Soluble

Medicinal Chemistry

PAINS :	0.0 alert
Brenk :	1.0 alert
Leadlikeness :	1.0
Synthetic accessibility :	1.68

Signal Word:	Warning	Class:
Precautionary Statements:	P280-P305+P351+P338	UN#:
Hazard Statements:	H317-H319	Packing Group:
GHS Pictogram:

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