| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 31st, 2007 | 37 | 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) | 5.90 | 12.59 | -67.05 | 0 | 7 | -1 | 92 | 513.595 | 7 | ↓ |
| Mid Mid (pH 6-8) | 5.32 | 12.52 | -24.94 | 0 | 7 | 0 | 86 | 514.603 | 7 | ↓ |
| Mid Mid (pH 6-8) | 6.35 | 11.55 | -32.12 | 1 | 7 | 0 | 89 | 514.603 | 6 | ↓ |
