| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 31st, 2009 | 33 | 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) | 1.05 | 8.94 | -55.46 | 3 | 8 | 0 | 124 | 452.507 | 8 | ↓ |
| Hi High (pH 8-9.5) | 1.05 | 6.78 | -51.88 | 2 | 8 | -1 | 119 | 451.499 | 8 | ↓ |
| Mid Mid (pH 6-8) | 1.05 | 7.62 | -67.74 | 2 | 8 | -1 | 119 | 451.499 | 8 | ↓ |
