| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 17th, 2010 | 16 | Yes |
Popular Name: (2S)-2-amino-3-[(4-fluorophenyl)methyl-methyl-amino]propanoic (2S)-2-amino-3-[(4-fluorophenyl)…
None
| 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) | -1.44 | 3.39 | -35.87 | 3 | 4 | 0 | 71 | 226.251 | 5 | ↓ |
| Hi High (pH 8-9.5) | -1.44 | 3 | -43.14 | 2 | 4 | -1 | 69 | 225.243 | 5 | ↓ |
| Hi High (pH 8-9.5) | -1.44 | 5.05 | -43.25 | 3 | 4 | 0 | 71 | 226.251 | 5 | ↓ |
| Lo Low (pH 4.5-6) | -1.44 | 5.42 | -90.29 | 4 | 4 | 1 | 72 | 227.259 | 5 | ↓ |
