| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 11th, 2011 | 31 | 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) | 1.81 | 4.83 | -89.61 | 4 | 7 | 0 | 111 | 444.553 | 11 | ↓ |
| Hi High (pH 8-9.5) | 1.81 | 3.48 | -49.79 | 3 | 7 | -1 | 107 | 443.545 | 11 | ↓ |
