| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 1st, 2007 | 32 | 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) | 5.46 | 11.33 | -54.18 | 0 | 6 | -1 | 86 | 463.922 | 5 | ↓ |
| Mid Mid (pH 6-8) | 4.88 | 11.58 | -11.32 | 0 | 6 | 0 | 80 | 464.93 | 5 | ↓ |
| Mid Mid (pH 6-8) | 5.90 | 11.39 | -19.66 | 1 | 6 | 0 | 84 | 464.93 | 4 | ↓ |
