| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 17th, 2010 | 16 | Yes |
Popular Name: (2S)-2-amino-3-[(4-chlorophenyl)methyl-methyl-amino]propanoic (2S)-2-amino-3-[(4-chlorophenyl)…
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) | -0.93 | 3.84 | -35.01 | 3 | 4 | 0 | 71 | 242.706 | 5 | ↓ |
| Hi High (pH 8-9.5) | -0.93 | 3.45 | -42.83 | 2 | 4 | -1 | 69 | 241.698 | 5 | ↓ |
| Hi High (pH 8-9.5) | -0.93 | 5.55 | -48.46 | 3 | 4 | 0 | 71 | 242.706 | 5 | ↓ |
| Lo Low (pH 4.5-6) | -0.93 | 5.88 | -89.21 | 4 | 4 | 1 | 72 | 243.714 | 5 | ↓ |
