| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 24th, 2008 | 33 | 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) | 3.06 | 7.15 | -109.07 | 4 | 8 | 2 | 104 | 444.539 | 8 | ↓ |
| Hi High (pH 8-9.5) | 3.06 | 6.11 | -45.63 | 3 | 8 | 1 | 102 | 443.531 | 8 | ↓ |
