| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 11th, 2010 | 34 | No |
None
| 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) | 7.54 | 9.62 | -37.6 | 1 | 6 | -1 | 94 | 581.35 | 6 | ↓ |
| Hi High (pH 8-9.5) | 7.54 | 9.77 | -99.46 | 0 | 6 | -2 | 96 | 580.342 | 6 | ↓ |
| Mid Mid (pH 6-8) | 7.54 | 9.24 | -10.71 | 2 | 6 | 0 | 92 | 582.358 | 6 | ↓ |
