| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 26th, 2004 | 32 | 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) | 2.96 | 7.71 | -61.14 | 0 | 7 | -1 | 88 | 440.447 | 7 | ↓ |
| Mid Mid (pH 6-8) | 3.40 | 5.95 | -30.79 | 1 | 7 | 0 | 85 | 441.455 | 6 | ↓ |
| Mid Mid (pH 6-8) | 2.37 | 6.8 | -23.44 | 0 | 7 | 0 | 82 | 441.455 | 7 | ↓ |
