| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 17th, 2010 | 17 | Yes |
Popular Name: (2S)-2-amino-3-[(3-methoxyphenyl)methyl-methyl-amino]propanoic (2S)-2-amino-3-[(3-methoxyphenyl…
| 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) | -1.57 | 2.7 | -33.59 | 3 | 5 | 0 | 80 | 238.287 | 6 | ↓ |
| Hi High (pH 8-9.5) | -1.57 | 1.96 | -43.99 | 2 | 5 | -1 | 79 | 237.279 | 6 | ↓ |
| Hi High (pH 8-9.5) | -1.57 | 4.3 | -41.53 | 3 | 5 | 0 | 80 | 238.287 | 6 | ↓ |
| Lo Low (pH 4.5-6) | -1.57 | 4.67 | -82.95 | 4 | 5 | 1 | 81 | 239.295 | 6 | ↓ |
