| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 24th, 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) | 4.58 | 9.58 | -54.84 | 0 | 7 | -1 | 96 | 465.894 | 5 | ↓ |
| Mid Mid (pH 6-8) | 5.02 | 8.56 | -28.1 | 1 | 7 | 0 | 93 | 466.902 | 4 | ↓ |
| Mid Mid (pH 6-8) | 3.99 | -0.83 | -15.07 | 0 | 7 | 0 | 89 | 466.902 | 5 | ↓ |
