| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 1st, 2009 | 29 | Yes |
| 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) | 3.47 | 12.32 | -44.85 | 1 | 5 | 1 | 56 | 414.526 | 5 | ↓ |
| Hi High (pH 8-9.5) | 3.47 | 10.06 | -16.1 | 0 | 5 | 0 | 55 | 413.518 | 5 | ↓ |
| Mid Mid (pH 6-8) | 3.47 | 12.72 | -93.85 | 2 | 5 | 2 | 57 | 415.534 | 5 | ↓ |
