| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 7th, 2007 | 35 | 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) | 5.65 | 12.57 | -54.23 | 0 | 6 | -1 | 83 | 487.532 | 6 | ↓ |
| Mid Mid (pH 6-8) | 5.07 | 12.8 | -11.82 | 0 | 6 | 0 | 77 | 488.54 | 6 | ↓ |
| Mid Mid (pH 6-8) | 6.10 | 11.89 | -19.26 | 1 | 6 | 0 | 80 | 488.54 | 5 | ↓ |
