| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 13th, 2007 | 33 | 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) | 3.21 | 7.65 | -53 | 0 | 7 | -1 | 82 | 469.945 | 8 | ↓ |
| Mid Mid (pH 6-8) | 2.63 | -0.62 | -51.87 | 1 | 7 | 1 | 77 | 471.961 | 8 | ↓ |
| Mid Mid (pH 6-8) | 3.21 | 9.97 | -68.55 | 1 | 7 | 0 | 83 | 470.953 | 8 | ↓ |
