| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 17th, 2009 | 19 | Yes |
Popular Name: 6-[(S)-amino-(3-bromophenyl)methyl]-3H-1,3-benzoxazol-2-one 6-[(S)-amino-(3-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) | 2.90 | 4.37 | -63.17 | 4 | 4 | 1 | 74 | 320.166 | 2 | ↓ |
| Hi High (pH 8-9.5) | 3.36 | 1.41 | -47.23 | 2 | 4 | -1 | 75 | 318.15 | 2 | ↓ |
| Mid Mid (pH 6-8) | 3.36 | 1.75 | -81.94 | 3 | 4 | 0 | 77 | 319.158 | 2 | ↓ |
