| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 17th, 2010 | 16 | Yes |
Popular Name: (2S)-2-amino-3-[(4-bromophenyl)methyl-methyl-amino]propanoic (2S)-2-amino-3-[(4-bromophenyl)m…
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) | -0.80 | 5.65 | -48.47 | 3 | 4 | 0 | 71 | 287.157 | 5 | ↓ |
| Hi High (pH 8-9.5) | -0.80 | 3.56 | -42.75 | 2 | 4 | -1 | 69 | 286.149 | 5 | ↓ |
| Mid Mid (pH 6-8) | -0.80 | 3.95 | -35.02 | 3 | 4 | 0 | 71 | 287.157 | 5 | ↓ |
| Lo Low (pH 4.5-6) | -0.80 | 5.98 | -89.47 | 4 | 4 | 1 | 72 | 288.165 | 5 | ↓ |
