| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 22nd, 2007 | 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) | 4.94 | 10.91 | -53.65 | 0 | 6 | -1 | 86 | 447.467 | 5 | ↓ |
| Mid Mid (pH 6-8) | 5.39 | 10.41 | -19.86 | 1 | 6 | 0 | 84 | 448.475 | 4 | ↓ |
| Mid Mid (pH 6-8) | 4.36 | 0.3 | -11.81 | 0 | 6 | 0 | 80 | 448.475 | 5 | ↓ |
