| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 8th, 2007 | 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) | 4.82 | 8.47 | -13.96 | 3 | 7 | 0 | 99 | 487.531 | 6 | ↓ |
| Hi High (pH 8-9.5) | 4.82 | 9.24 | -40.83 | 2 | 7 | -1 | 102 | 486.523 | 6 | ↓ |
| Hi High (pH 8-9.5) | 4.59 | 8.8 | -50.52 | 1 | 7 | -1 | 98 | 486.523 | 6 | ↓ |
| Hi High (pH 8-9.5) | 4.59 | 9.29 | -57.77 | 1 | 7 | -1 | 98 | 486.523 | 6 | ↓ |
