| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 9th, 2006 | 28 | 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) | 4.31 | 12.82 | -119.5 | 0 | 4 | -2 | 80 | 400.54 | 4 | ↓ |
| Mid Mid (pH 6-8) | 4.31 | 11.63 | -39.86 | 1 | 4 | -1 | 77 | 401.548 | 4 | ↓ |
| Mid Mid (pH 6-8) | 4.31 | 11.66 | -39.56 | 1 | 4 | -1 | 77 | 401.548 | 4 | ↓ |
| Mid Mid (pH 6-8) | 3.73 | 11.89 | -40.54 | 0 | 4 | -1 | 74 | 401.548 | 4 | ↓ |
