| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 1st, 2009 | 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) | 3.01 | 5.18 | -32.88 | 5 | 12 | 1 | 162 | 460.906 | 6 | ↓ |
| Hi High (pH 8-9.5) | 3.01 | 3.76 | -37.61 | 3 | 12 | -1 | 163 | 458.89 | 6 | ↓ |
| Hi High (pH 8-9.5) | 3.01 | 5.97 | -42.35 | 4 | 12 | 0 | 165 | 459.898 | 6 | ↓ |
