| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 31st, 2008 | 32 | Yes |
| 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) | 5.91 | 11.84 | -48.51 | 1 | 4 | 1 | 30 | 462.561 | 4 | ↓ |
| Hi High (pH 8-9.5) | 5.91 | 9.57 | -8.92 | 0 | 4 | 0 | 28 | 461.553 | 4 | ↓ |
| Hi High (pH 8-9.5) | 5.91 | 14.21 | -135.82 | 2 | 4 | 2 | 31 | 463.569 | 4 | ↓ |
| Mid Mid (pH 6-8) | 5.91 | 11.96 | -46.94 | 1 | 4 | 1 | 30 | 462.561 | 4 | ↓ |
