| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 20th, 2008 | 31 | 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) | 3.30 | 10.53 | -77.31 | 2 | 6 | 0 | 85 | 416.477 | 6 | ↓ |
| Hi High (pH 8-9.5) | 3.30 | 8.83 | -137.33 | 0 | 6 | -2 | 87 | 414.461 | 6 | ↓ |
| Mid Mid (pH 6-8) | 3.30 | 11.37 | -135.02 | 1 | 6 | -1 | 88 | 415.469 | 6 | ↓ |
