| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 7th, 2006 | 28 | 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) | 1.77 | 5.71 | -60.48 | 0 | 7 | -1 | 88 | 400.432 | 6 | ↓ |
| Mid Mid (pH 6-8) | 1.77 | -2.31 | -15.03 | 1 | 7 | 0 | 85 | 401.44 | 6 | ↓ |
| Mid Mid (pH 6-8) | 1.19 | -2.44 | -15.6 | 0 | 7 | 0 | 82 | 401.44 | 6 | ↓ |
