| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 27th, 2011 | 23 | No |
Popular Name: (2S)-2-[[(1R)-1-ethoxycarbonyl-3-phenyl-propyl]amino]-4-methyl-pentanoic (2S)-2-[[(1R)-1-ethoxycarbonyl-3…
| 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) | 2.07 | 10.95 | -36.73 | 2 | 5 | 0 | 83 | 321.417 | 11 | ↓ |
| Hi High (pH 8-9.5) | 2.07 | 9.29 | -47.48 | 1 | 5 | -1 | 78 | 320.409 | 11 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| PUBCHEM_PATENT_ID | EP0186431A1; US4711882 | IBM Patent Data |
