| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 19th, 2008 | 34 | 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) | 2.39 | 6.98 | -60.5 | 0 | 8 | -1 | 95 | 465.526 | 7 | ↓ |
| Mid Mid (pH 6-8) | 2.39 | 9.3 | -78.12 | 1 | 8 | 0 | 96 | 466.534 | 7 | ↓ |
| Mid Mid (pH 6-8) | 2.24 | 6.23 | -45.15 | 2 | 4 | 1 | 43 | 309.455 | 5 | ↓ |
