| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 11th, 2010 | 10 | Yes |
Popular Name: h-d-asp-ome h-d-asp-ome
Find On: PubMed — Wikipedia — Google
CAS Numbers: 129902-07-4 , 17812-32-7 , 65414-77-9 , 65414-78-0
(R)-3-Amino-4-methoxy-4-oxobutanoic acid
(R)-3-Amino-4-methoxy-4-oxobutanoic acid hydrochloride
3-Amino-4-methoxy-4-oxobutanoic acid
L-ASPARTIC ACID b-METHYLESTER HYDROCHLORIDE; [16856-13-6]
L-Aspartic Acid Methylester Hydrochloride [16856-13-6]; (H-Asp-(OMe)-OH HCl)
| 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) | -1.45 | 0.76 | -42.46 | 2 | 5 | -1 | 92 | 146.122 | 4 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| MP | 191-193°C | Indofine |
| PUBCHEM_PATENT_ID | WO2000071572A1 | IBM Patent Data |
