| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 24th, 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) | 2.75 | 4.22 | -24.38 | 2 | 8 | 0 | 112 | 420.878 | 5 | ↓ |
| Hi High (pH 8-9.5) | 3.21 | 2.48 | -56.67 | 1 | 8 | -1 | 115 | 419.87 | 5 | ↓ |
