| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 8th, 2006 | 31 | No |
| 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) | 3.12 | 10.23 | -46.32 | 0 | 9 | -1 | 132 | 455.859 | 5 | ↓ |
| Mid Mid (pH 6-8) | 2.54 | 0.34 | -18.44 | 0 | 9 | 0 | 126 | 456.867 | 5 | ↓ |
| Mid Mid (pH 6-8) | 3.56 | 0.04 | -26.98 | 1 | 9 | 0 | 129 | 456.867 | 4 | ↓ |
