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[ CAS No. 150-90-3 ] {[proInfo.proName]}

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Cat. No.: {[proInfo.prAm]}
Chemical Structure| 150-90-3
Chemical Structure| 150-90-3
Structure of 150-90-3 * Storage: {[proInfo.prStorage]}

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Quality Control of [ 150-90-3 ]

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Product Details of [ 150-90-3 ]

CAS No. :150-90-3 MDL No. :MFCD00002790
Formula : C4H4Na2O4 Boiling Point : No data available
Linear Structure Formula :- InChI Key :ZDQYSKICYIVCPN-UHFFFAOYSA-L
M.W : 162.05 Pubchem ID :9020
Synonyms :
Chemical Name :Sodium Succinate

Calculated chemistry of [ 150-90-3 ]      Expand+

Physicochemical Properties

Num. heavy atoms : 10
Num. arom. heavy atoms : 0
Fraction Csp3 : 0.5
Num. rotatable bonds : 3
Num. H-bond acceptors : 4.0
Num. H-bond donors : 0.0
Molar Refractivity : 21.0
TPSA : 80.26 ?2

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) : -7.71 cm/s

Lipophilicity

Log Po/w (iLOGP) : -19.59
Log Po/w (XLOGP3) : -0.59
Log Po/w (WLOGP) : -2.73
Log Po/w (MLOGP) : -0.54
Log Po/w (SILICOS-IT) : -0.63
Consensus Log Po/w : -4.82

Druglikeness

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

Water Solubility

Log S (ESOL) : -0.28
Solubility : 86.0 mg/ml ; 0.531 mol/l
Class : Very soluble
Log S (Ali) : -0.62
Solubility : 38.5 mg/ml ; 0.237 mol/l
Class : Very soluble
Log S (SILICOS-IT) : 0.61
Solubility : 666.0 mg/ml ; 4.11 mol/l
Class : Soluble

Medicinal Chemistry

PAINS : 0.0 alert
Brenk : 0.0 alert
Leadlikeness : 1.0
Synthetic accessibility : 1.42

Safety of [ 150-90-3 ]

Signal Word:Warning Class:
Precautionary Statements:P261-P305+P351+P338 UN#:
Hazard Statements:H315-H319-H335 Packing Group:
GHS Pictogram:
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