| 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) | 1.84 | 6.94 | -73.23 | 2 | 8 | 0 | 107 | 425.485 | 9 | ↓ |
| Hi High (pH 8-9.5) | 1.84 | 5.74 | -130.39 | 0 | 8 | -2 | 109 | 423.469 | 9 | ↓ |
| Mid Mid (pH 6-8) | 1.84 | 7.97 | -129.65 | 1 | 8 | -1 | 110 | 424.477 | 9 | ↓ |
