51674-17-0 Sodiumthiophosphatedodecahydrate

Introduction

CAS No. :	51674-17-0	MDL No. :	MFCD00150620
Formula :	H24Na3O15PS	Boiling Point :	-
Linear Structure Formula :	-	InChI Key :	AALQBIFJJJPDHJ-UHFFFAOYSA-K
M.W :	396.19	Pubchem ID :	45052183
Synonyms :

Physicochemical Properties

Num. heavy atoms :	20
Num. arom. heavy atoms :	0
Fraction Csp3 :	None
Num. rotatable bonds :	0
Num. H-bond acceptors :	None
Num. H-bond donors :	None
Molar Refractivity :	53.14
TPSA :	221.84 Ų

Pharmacokinetics

GI absorption :	None
BBB permeant :	None
P-gp substrate :	None
CYP1A2 inhibitor :	None
CYP2C19 inhibitor :	None
CYP2C9 inhibitor :	None
CYP2D6 inhibitor :	None
CYP3A4 inhibitor :	None
Log Kp (skin permeation) :	None cm/s

Lipophilicity

Log Po/w (iLOGP) :	None
Log Po/w (XLOGP3) :	None
Log Po/w (WLOGP) :	None
Log Po/w (MLOGP) :	None
Log Po/w (SILICOS-IT) :	None
Consensus Log Po/w :	None

Druglikeness

Lipinski :	None
Ghose :	None
Veber :	None
Egan :	None
Muegge :	None
Bioavailability Score :	None

Water Solubility

Log S (ESOL) :	None
Solubility :	None mg/ml ; None mol/l
Class :	None
Log S (Ali) :	None
Solubility :	None mg/ml ; None mol/l
Class :	None
Log S (SILICOS-IT) :	None
Solubility :	None mg/ml ; None mol/l
Class :	None

Medicinal Chemistry

PAINS :	None alert
Brenk :	None alert
Leadlikeness :	None
Synthetic accessibility :	None

Signal Word:	Danger	Class:	9
Precautionary Statements:	P501-P273-P260-P270-P264-P280-P391-P314-P337+P313-P305+P351+P338-P301+P312+P330	UN#:	3077
Hazard Statements:	H302-H319-H372-H410	Packing Group:	Ⅲ
GHS Pictogram:

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