| 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) | 7.55 | 13.47 | -11.2 | 2 | 6 | 0 | 78 | 530.068 | 9 | ↓ |
| Hi High (pH 8-9.5) | 7.32 | 14.21 | -56.06 | 0 | 6 | -1 | 77 | 529.06 | 9 | ↓ |
| Hi High (pH 8-9.5) | 7.32 | 13.35 | -55.31 | 0 | 6 | -1 | 77 | 529.06 | 9 | ↓ |
| Hi High (pH 8-9.5) | 7.55 | 14.23 | -47.75 | 1 | 6 | -1 | 81 | 529.06 | 9 | ↓ |
