| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 15th, 2006 | 28 | 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) | -2.70 | -9.71 | -23.13 | 7 | 12 | 0 | 205 | 414.396 | 8 | ↓ |
| Hi High (pH 8-9.5) | -2.25 | -12.26 | -96.86 | 5 | 12 | -2 | 210 | 412.38 | 8 | ↓ |
| Mid Mid (pH 6-8) | -2.25 | -12.48 | -54.57 | 6 | 12 | -1 | 208 | 413.388 | 8 | ↓ |
