| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 18th, 2006 | 29 | 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) | 4.62 | 9.36 | -32.94 | 2 | 6 | 0 | 84 | 411.527 | 6 | ↓ |
| Hi High (pH 8-9.5) | 5.25 | -2.57 | -11.3 | 2 | 6 | 0 | 84 | 411.527 | 6 | ↓ |
| Mid Mid (pH 6-8) | 5.08 | 7.98 | -61.85 | 1 | 6 | -1 | 87 | 410.519 | 6 | ↓ |
