| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 11th, 2009 | 22 | 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) | -2.57 | -7.42 | -161.2 | 5 | 12 | -2 | 203 | 337.181 | 4 | ↓ |
| Hi High (pH 8-9.5) | -2.57 | -6.98 | -209.99 | 4 | 12 | -3 | 206 | 336.173 | 4 | ↓ |
| Mid Mid (pH 6-8) | -2.57 | -8.57 | -65.63 | 6 | 12 | -1 | 200 | 338.189 | 4 | ↓ |
