| 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) | 7.04 | 12.69 | -11.22 | 2 | 6 | 0 | 78 | 516.041 | 8 | ↓ |
| Hi High (pH 8-9.5) | 6.81 | 13.43 | -56.18 | 0 | 6 | -1 | 77 | 515.033 | 8 | ↓ |
| Hi High (pH 8-9.5) | 6.81 | 12.57 | -55.37 | 0 | 6 | -1 | 77 | 515.033 | 8 | ↓ |
| Hi High (pH 8-9.5) | 7.04 | 13.45 | -47.84 | 1 | 6 | -1 | 81 | 515.033 | 8 | ↓ |
