| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 24th, 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) | 4.46 | 11.45 | -56.11 | 0 | 9 | -1 | 125 | 481.525 | 12 | ↓ |
| Mid Mid (pH 6-8) | 4.91 | 10.43 | -31.21 | 1 | 9 | 0 | 122 | 482.533 | 11 | ↓ |
| Mid Mid (pH 6-8) | 3.88 | 0.85 | -26.55 | 0 | 9 | 0 | 118 | 482.533 | 12 | ↓ |
