| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 1st, 2007 | 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) | 5.77 | 12.11 | -56.31 | 0 | 6 | -1 | 83 | 489.96 | 5 | ↓ |
| Mid Mid (pH 6-8) | 5.18 | 12.3 | -12.24 | 0 | 6 | 0 | 77 | 490.968 | 5 | ↓ |
| Mid Mid (pH 6-8) | 6.21 | 11.49 | -19.65 | 1 | 6 | 0 | 80 | 490.968 | 4 | ↓ |
