In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 26th, 2010 | 18 | Yes |
Popular Name: (4aS,8aS)-4-[(4-bromophenyl)methyl]-2,3,4a,5,6,7,8,8a-octahydrobenzo[b][1,4]oxazine (4aS,8aS)-4-[(4-bromophenyl)meth…
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) | 3.78 | 6.62 | -2.94 | 0 | 2 | 0 | 12 | 310.235 | 2 | ↓ |
Lo Low (pH 4.5-6) | 3.78 | 8.83 | -37.88 | 1 | 2 | 1 | 14 | 311.243 | 2 | ↓ |