| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 29th, 2008 | 28 | 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) | 4.13 | 8.05 | -15.12 | 2 | 5 | 0 | 76 | 442.309 | 3 | ↓ |
| Hi High (pH 8-9.5) | 4.13 | 8.82 | -55.1 | 1 | 5 | -1 | 78 | 441.301 | 3 | ↓ |
