In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 26th, 2005 | 25 | Yes |
Popular Name: Efaproxiral sodium Efaproxiral sodium
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CAS Numbers: 131179-95-8 , 170787-99-2 , [170787-99-2]
170787-99-2; D03962; Efaproxiral sodium (USAN)
2-(4-(((3,5-dimethylanilino)carbonyl)methyl)phenoxy)-2-methylpropionic acid
2-(4-(2-((3,5-Dimethylphenyl)amino)-2-oxoethyl)phenoxy)-2-methylpropanoic acid
2-(4-(2-((3,5-Dimethylphenyl)amino)-2-oxoethyl)phenoxy)-2-methylpropanoicacid
2-{4-[(3,5-DIMETHYLANILINO)-CARBONYL-METHYL]-PHENOXY}-2-METHYLPROPIONIC ACID
INN); Efaproxiral Sodium (USAN)
Sodium 2-(4-(2-((3,5-dimethylphenyl)amino)-2-oxoethyl)phenoxy)-2-methylpropanoate
Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
---|---|---|---|---|---|---|---|---|---|---|
Ref Reference (pH 7) | 3.86 | 9.33 | -61.83 | 1 | 5 | -1 | 78 | 340.399 | 6 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
ALOGPS_SOLUBILITY | 2.70e-03 g/l | DrugBank-experimental |
Target | Others | Selleck Chemicals |