| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 1st, 2004 | 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) | 3.52 | 9.81 | -21.83 | 2 | 8 | 0 | 106 | 458.565 | 9 | ↓ |
| Hi High (pH 8-9.5) | 3.52 | 9.65 | -49.14 | 1 | 8 | -1 | 105 | 457.557 | 9 | ↓ |
