| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 30th, 2007 | 36 | 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) | 5.05 | 9.11 | -14.45 | 3 | 7 | 0 | 99 | 507.949 | 6 | ↓ |
| Ref Reference (pH 7) | 5.05 | 8.72 | -13.73 | 3 | 7 | 0 | 99 | 507.949 | 6 | ↓ |
| Hi High (pH 8-9.5) | 5.03 | 9.3 | -43.03 | 1 | 7 | -1 | 98 | 506.941 | 6 | ↓ |
| Hi High (pH 8-9.5) | 5.03 | 8.99 | -54.67 | 1 | 7 | -1 | 98 | 506.941 | 6 | ↓ |
| Hi High (pH 8-9.5) | 5.05 | 9.87 | -38.67 | 2 | 7 | -1 | 102 | 506.941 | 6 | ↓ |
| Mid Mid (pH 6-8) | 5.05 | 9.5 | -48.57 | 2 | 7 | -1 | 102 | 506.941 | 6 | ↓ |
