Alternatived Products of [ 108392-02-5 ]
Product Details of [ 108392-02-5 ]
CAS No. : 108392-02-5
MDL No. : MFCD00674303
Formula :
C39 H73 NaO8 P
Boiling Point :
-
Linear Structure Formula : -
InChI Key : -
M.W :
723.96
Pubchem ID : -
Synonyms :
18:1 PA;1,2-Dioctadecenoyl-sn-glycero-3-PA;18:1/18:1-PA;1,2-DOPA;1,2-Dioleoyl-sn-glycero-3-phosphatidic Acid;1,2-Dioleoyl-sn-glycero-3-phosphate;1,2-Dioctadecenoyl-sn-glycero-3-phosphatidic Acid;1,2-Dioleoyl-sn-glycero-3-PA (sodium salt)
Chemical Name : (Z)-(R)-3-(Phosphonooxy)propane-1,2-diyl dioleate sodium salt
Calculated chemistry of [ 108392-02-5 ]
Physicochemical Properties
Num. heavy atoms :
49
Num. arom. heavy atoms :
0
Fraction Csp3 :
0.85
Num. rotatable bonds :
38
Num. H-bond acceptors :
8.0
Num. H-bond donors :
2.0
Molar Refractivity :
203.28
TPSA :
129.17 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) :
11.63
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
Safety of [ 108392-02-5 ]
Categories