| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 19th, 2011 | 20 | No |
Popular Name: (2S)-2-amino-3-[[(3R)-1,1-dioxothiolan-3-yl]-methyl-amino]-2-phenyl-propan-1-ol (2S)-2-amino-3-[[(3R)-1,1-dioxot…
| 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) | 0.29 | -1.54 | -61 | 4 | 5 | 1 | 85 | 299.416 | 5 | ↓ |
| Hi High (pH 8-9.5) | 0.29 | -1.71 | -13.24 | 3 | 5 | 0 | 84 | 298.408 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 0.29 | 0.15 | -53.11 | 4 | 5 | 1 | 85 | 299.416 | 5 | ↓ |
