| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 15th, 2010 | 34 | 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) | 3.16 | 6.07 | -14.41 | 2 | 9 | 0 | 106 | 467.522 | 8 | ↓ |
| Hi High (pH 8-9.5) | 2.93 | 6.28 | -53.94 | 0 | 9 | -1 | 105 | 466.514 | 8 | ↓ |
| Hi High (pH 8-9.5) | 2.93 | 5.96 | -61.41 | 0 | 9 | -1 | 105 | 466.514 | 8 | ↓ |
| Hi High (pH 8-9.5) | 3.16 | 7.12 | -42.82 | 1 | 9 | -1 | 109 | 466.514 | 8 | ↓ |
