| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 24th, 2006 | 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) | 0.98 | 2.12 | -66.28 | 2 | 8 | -1 | 119 | 412.418 | 9 | ↓ |
| Mid Mid (pH 6-8) | 1.42 | 1.1 | -33.4 | 3 | 8 | 0 | 117 | 413.426 | 8 | ↓ |
| Mid Mid (pH 6-8) | 0.39 | 2.11 | -26.44 | 2 | 8 | 0 | 113 | 413.426 | 9 | ↓ |
