| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 11th, 2008 | 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) | 1.31 | 8.22 | -48.15 | 3 | 7 | 0 | 114 | 416.433 | 3 | ↓ |
| Hi High (pH 8-9.5) | 1.31 | 7.39 | -64.03 | 2 | 7 | -1 | 110 | 415.425 | 3 | ↓ |
| Hi High (pH 8-9.5) | 1.31 | 9.08 | -65.89 | 2 | 7 | -1 | 117 | 415.425 | 3 | ↓ |
