| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 9th, 2008 | 31 | 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) | 5.30 | 11.17 | -74.75 | 2 | 5 | 1 | 53 | 472.421 | 4 | ↓ |
| Mid Mid (pH 6-8) | 5.30 | 9.72 | -13.71 | 1 | 5 | 0 | 52 | 471.413 | 4 | ↓ |
| Mid Mid (pH 6-8) | 5.75 | 10.94 | -42.84 | 1 | 5 | 0 | 57 | 471.413 | 4 | ↓ |
| Mid Mid (pH 6-8) | 5.30 | 13.06 | -58.42 | 2 | 5 | 1 | 53 | 472.421 | 4 | ↓ |
