| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 30th, 2007 | 35 | 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) | 6.31 | 11.72 | -14.17 | 2 | 6 | 0 | 78 | 508.405 | 6 | ↓ |
| Ref Reference (pH 7) | 6.31 | 11.06 | -11.87 | 2 | 6 | 0 | 78 | 508.405 | 6 | ↓ |
| Hi High (pH 8-9.5) | 6.29 | 11.84 | -39.7 | 0 | 6 | -1 | 77 | 507.397 | 6 | ↓ |
| Hi High (pH 8-9.5) | 6.29 | 11.38 | -50.71 | 0 | 6 | -1 | 77 | 507.397 | 6 | ↓ |
| Hi High (pH 8-9.5) | 6.31 | 11.9 | -34.12 | 1 | 6 | -1 | 81 | 507.397 | 6 | ↓ |
| Mid Mid (pH 6-8) | 6.31 | 11.83 | -47.04 | 1 | 6 | -1 | 81 | 507.397 | 6 | ↓ |
