| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 15th, 2010 | 39 | 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) | 5.84 | 11.74 | -15.96 | 2 | 8 | 0 | 97 | 535.685 | 12 | ↓ |
| Hi High (pH 8-9.5) | 5.61 | 11.43 | -61.47 | 0 | 8 | -1 | 96 | 534.677 | 12 | ↓ |
| Hi High (pH 8-9.5) | 5.61 | 11.71 | -52.7 | 0 | 8 | -1 | 96 | 534.677 | 12 | ↓ |
| Hi High (pH 8-9.5) | 5.84 | 12.73 | -46.15 | 1 | 8 | -1 | 100 | 534.677 | 12 | ↓ |
