| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 31st, 2009 | 31 | 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) | 3.98 | 4.82 | -18.1 | 3 | 6 | 0 | 96 | 441.377 | 6 | ↓ |
| Hi High (pH 8-9.5) | 3.98 | 5.58 | -62.54 | 2 | 6 | -1 | 99 | 440.369 | 6 | ↓ |
