| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 1st, 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) | -0.33 | 5.81 | -63.01 | 4 | 11 | 0 | 180 | 455.423 | 5 | ↓ |
| Hi High (pH 8-9.5) | -0.33 | 3.68 | -51.12 | 3 | 11 | -1 | 176 | 454.415 | 5 | ↓ |
| Mid Mid (pH 6-8) | -0.33 | 4.5 | -74.89 | 3 | 11 | -1 | 176 | 454.415 | 5 | ↓ |
