| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 15th, 2010 | 38 | 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) | 5.44 | 11 | -17.13 | 2 | 8 | 0 | 97 | 521.658 | 12 | ↓ |
| Hi High (pH 8-9.5) | 5.21 | 11.52 | -61.58 | 0 | 8 | -1 | 96 | 520.65 | 12 | ↓ |
| Hi High (pH 8-9.5) | 5.21 | 11.34 | -52.44 | 0 | 8 | -1 | 96 | 520.65 | 12 | ↓ |
| Hi High (pH 8-9.5) | 5.44 | 11.92 | -44.42 | 1 | 8 | -1 | 100 | 520.65 | 12 | ↓ |
