In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 13th, 2010 | 16 | Yes |
Popular Name: (4aS,8aS)-4-[(3R)-3-piperidyl]-2,3,4a,5,6,7,8,8a-octahydrobenzo[b][1,4]oxazine (4aS,8aS)-4-[(3R)-3-piperidyl]-2…
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) | 1.40 | 1.52 | -2.12 | 1 | 3 | 0 | 24 | 224.348 | 1 | ↓ |
Lo Low (pH 4.5-6) | 1.40 | 3.64 | -30.33 | 2 | 3 | 1 | 26 | 225.356 | 1 | ↓ |
Lo Low (pH 4.5-6) | 1.40 | 4.97 | -107.62 | 3 | 3 | 2 | 30 | 226.364 | 1 | ↓ |