| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 24th, 2008 | 33 | 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) | 4.29 | 7.32 | -21.25 | 2 | 8 | 0 | 112 | 482.949 | 6 | ↓ |
| Hi High (pH 8-9.5) | 4.75 | 5.58 | -54.07 | 1 | 8 | -1 | 115 | 481.941 | 6 | ↓ |
| Hi High (pH 8-9.5) | 4.75 | 5.31 | -70.22 | 1 | 8 | -1 | 115 | 481.941 | 6 | ↓ |
