| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 3rd, 2008 | 28 | 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) | 5.08 | 8.01 | -11.75 | 2 | 5 | 0 | 67 | 372.424 | 6 | ↓ |
| Hi High (pH 8-9.5) | 5.08 | 8.78 | -46.71 | 1 | 5 | -1 | 70 | 371.416 | 6 | ↓ |
| Hi High (pH 8-9.5) | 4.72 | 8.93 | -58.61 | 0 | 5 | -1 | 66 | 371.416 | 6 | ↓ |
| Hi High (pH 8-9.5) | 4.72 | 8.95 | -58.56 | 0 | 5 | -1 | 66 | 371.416 | 6 | ↓ |
| Hi High (pH 8-9.5) | 5.08 | 8.77 | -58.44 | 1 | 5 | -1 | 70 | 371.416 | 6 | ↓ |
| Mid Mid (pH 6-8) | 5.08 | 8.02 | -9.84 | 2 | 5 | 0 | 67 | 372.424 | 6 | ↓ |
