| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 11th, 2009 | 30 | 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) | 4.27 | 9.85 | -23.6 | 1 | 8 | 0 | 118 | 442.836 | 4 | ↓ |
| Hi High (pH 8-9.5) | 4.27 | 10.64 | -68.7 | 0 | 8 | -1 | 121 | 441.828 | 4 | ↓ |
