| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 15th, 2010 | 37 | 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) | 6.86 | 12.73 | -10.79 | 2 | 6 | 0 | 78 | 495.623 | 8 | ↓ |
| Hi High (pH 8-9.5) | 6.63 | 13.74 | -54.72 | 0 | 6 | -1 | 77 | 494.615 | 8 | ↓ |
| Hi High (pH 8-9.5) | 6.63 | 13.77 | -54.02 | 0 | 6 | -1 | 77 | 494.615 | 8 | ↓ |
| Hi High (pH 8-9.5) | 6.86 | 13.62 | -46.81 | 1 | 6 | -1 | 81 | 494.615 | 8 | ↓ |
