| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 8th, 2009 | 20 | Yes |
Popular Name: 6-[(R)-(5-bromo-3-pyridyl)-(methylamino)methyl]-3H-1,3-benzoxazol-2-one 6-[(R)-(5-bromo-3-pyridyl)-(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) | 2.21 | 4.31 | -60.86 | 3 | 5 | 1 | 75 | 335.181 | 3 | ↓ |
| Hi High (pH 8-9.5) | 2.67 | 0.7 | -47.94 | 1 | 5 | -1 | 74 | 333.165 | 3 | ↓ |
| Mid Mid (pH 6-8) | 2.21 | 3.32 | -9.55 | 2 | 5 | 0 | 71 | 334.173 | 3 | ↓ |
| Mid Mid (pH 6-8) | 2.67 | 1.69 | -79.25 | 2 | 5 | 0 | 79 | 334.173 | 3 | ↓ |
