| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 1st, 2009 | 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) | -0.85 | 7.35 | -48.95 | 3 | 11 | 0 | 169 | 441.396 | 6 | ↓ |
| Hi High (pH 8-9.5) | -0.85 | 5.6 | -49.66 | 2 | 11 | -1 | 165 | 440.388 | 6 | ↓ |
| Mid Mid (pH 6-8) | -0.85 | 7.07 | -56.25 | 2 | 11 | -1 | 165 | 440.388 | 6 | ↓ |
