| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 17th, 2010 | 16 | Yes |
Popular Name: (2S)-3-[(4aR,8aS)-2,3,4a,5,6,7,8,8a-octahydrobenzo[b][1,4]oxazin-4-yl]-2-amino-propanoic (2S)-3-[(4aR,8aS)-2,3,4a,5,6,7,8…
| 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) | -1.77 | 1.63 | -34.64 | 3 | 5 | 0 | 80 | 228.292 | 3 | ↓ |
| Mid Mid (pH 6-8) | -1.77 | 3.13 | -37.63 | 3 | 5 | 0 | 80 | 228.292 | 3 | ↓ |
| Mid Mid (pH 6-8) | -1.77 | 1.23 | -44.36 | 2 | 5 | -1 | 79 | 227.284 | 3 | ↓ |
| Mid Mid (pH 6-8) | -1.77 | 3.48 | -83.56 | 4 | 5 | 1 | 81 | 229.3 | 3 | ↓ |
