| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 30th, 2007 | 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) | 7.15 | 12.89 | -16.46 | 2 | 6 | 0 | 78 | 516.041 | 7 | ↓ |
| Ref Reference (pH 7) | 7.15 | 12.84 | -11.54 | 2 | 6 | 0 | 78 | 516.041 | 7 | ↓ |
| Hi High (pH 8-9.5) | 7.12 | 12.68 | -51.24 | 0 | 6 | -1 | 77 | 515.033 | 7 | ↓ |
| Hi High (pH 8-9.5) | 7.12 | 12.65 | -48.94 | 0 | 6 | -1 | 77 | 515.033 | 7 | ↓ |
| Hi High (pH 8-9.5) | 7.15 | 13.65 | -41.35 | 1 | 6 | -1 | 81 | 515.033 | 7 | ↓ |
| Mid Mid (pH 6-8) | 7.15 | 13.61 | -48.46 | 1 | 6 | -1 | 81 | 515.033 | 7 | ↓ |
