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Potassium formate

Potassium formate

CAS No. :590-29-4MDL No. :MFCD00013100Formula :CHKO2Boiling Point :No data availableLinear Structure Formula :-InChI Key

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CAS No. :590-29-4 Brand :Qitai
Formula :CHKO2 M.W :84.12

Introduction

CAS No. :590-29-4 MDL No. :MFCD00013100
Formula : CHKO2 Boiling Point : No data available
Linear Structure Formula :- InChI Key :WFIZEGIEIOHZCP-UHFFFAOYSA-M
M.W : 84.12 Pubchem ID :2735122
Synonyms :

Physicochemical Properties

Num. heavy atoms : 4
Num. arom. heavy atoms : 0
Fraction Csp3 : 0.0
Num. rotatable bonds : 0
Num. H-bond acceptors : 2.0
Num. H-bond donors : 0.0
Molar Refractivity : 7.14
TPSA : 40.13 Ų

Pharmacokinetics

GI absorption : Low
BBB permeant : No
P-gp substrate : Yes
CYP1A2 inhibitor : No
CYP2C19 inhibitor : No
CYP2C9 inhibitor : No
CYP2D6 inhibitor : No
CYP3A4 inhibitor : No
Log Kp (skin permeation) : -6.96 cm/s

Lipophilicity

Log Po/w (iLOGP) : -3.74
Log Po/w (XLOGP3) : -0.2
Log Po/w (WLOGP) : -1.63
Log Po/w (MLOGP) : -1.13
Log Po/w (SILICOS-IT) : -0.23
Consensus Log Po/w : -1.39

Druglikeness

Lipinski : 0.0
Ghose : None
Veber : 0.0
Egan : 0.0
Muegge : 2.0
Bioavailability Score : 0.55

Water Solubility

Log S (ESOL) : -0.24
Solubility : 48.9 mg/ml ; 0.581 mol/l
Class : Very soluble
Log S (Ali) : -0.19
Solubility : 54.8 mg/ml ; 0.651 mol/l
Class : Very soluble
Log S (SILICOS-IT) : 0.97
Solubility : 790.0 mg/ml ; 9.4 mol/l
Class : Soluble

Medicinal Chemistry

PAINS : 0.0 alert
Brenk : 1.0 alert
Leadlikeness : 1.0
Synthetic accessibility : 1.74
Signal Word:Warning Class:
Precautionary Statements:P280-P305+P351+P338-P310 UN#:
Hazard Statements:H302-H315-H319-H332-H335 Packing Group:
GHS Pictogram: