In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 12th, 2006 | 11 | Yes |
Popular Name: Methyl1-ethylpyrrolidine-2-carboxylate Methyl1-ethylpyrrolidine-2-carbo…
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CAS Number: 107599-40-6
(S) Methyl 1-ethylpyrrolidine-2-carboxylate
L-Proline, 1-ethyl-, methyl ester (9CI)
L-Proline, 1-ethyl-,methyl ester
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) | 0.97 | 4.95 | -32.72 | 1 | 3 | 1 | 31 | 158.221 | 3 | ↓ |
Note Type | Comments | Provided By |
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PUBCHEM_PATENT_ID | EP0253785A1; EP0253785B1; EP0270596A1; US5300660; US5468876 | IBM Patent Data |