| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 8th, 2009 | 21 | Yes |
Popular Name: 6-[(1S)-2-(4-fluorophenyl)-1-(methylamino)ethyl]-3H-1,3-benzoxazol-2-one 6-[(1S)-2-(4-fluorophenyl)-1-(me…
| 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) | 2.86 | 6.19 | -66.46 | 3 | 4 | 1 | 63 | 287.314 | 4 | ↓ |
| Hi High (pH 8-9.5) | 3.32 | 3.56 | -89.78 | 2 | 4 | 0 | 66 | 286.306 | 4 | ↓ |
| Hi High (pH 8-9.5) | 3.32 | 2.62 | -48.9 | 1 | 4 | -1 | 61 | 285.298 | 4 | ↓ |
| Hi High (pH 8-9.5) | 2.86 | 5.26 | -10.83 | 2 | 4 | 0 | 58 | 286.306 | 4 | ↓ |
