| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 15th, 2010 | 36 | 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) | 6.25 | 12.15 | -16.68 | 2 | 6 | 0 | 78 | 499.998 | 7 | ↓ |
| Hi High (pH 8-9.5) | 6.02 | 12.72 | -46.93 | 0 | 6 | -1 | 77 | 498.99 | 7 | ↓ |
| Hi High (pH 8-9.5) | 6.02 | 12.26 | -55.9 | 0 | 6 | -1 | 77 | 498.99 | 7 | ↓ |
| Hi High (pH 8-9.5) | 6.25 | 13.1 | -40.54 | 1 | 6 | -1 | 81 | 498.99 | 7 | ↓ |
