| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 1st, 2008 | 30 | No |
| 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) | 1.71 | 9 | -67.71 | 1 | 8 | 0 | 96 | 414.458 | 8 | ↓ |
| Hi High (pH 8-9.5) | 1.71 | 6.47 | -58.21 | 0 | 8 | -1 | 95 | 413.45 | 8 | ↓ |
| Mid Mid (pH 6-8) | 1.71 | 8.2 | -42.84 | 2 | 8 | 1 | 94 | 415.466 | 8 | ↓ |
| Mid Mid (pH 6-8) | 1.12 | 8.89 | -52.86 | 1 | 8 | 1 | 90 | 415.466 | 8 | ↓ |
