| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 12th, 2010 | 30 | 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) | -0.04 | 1.1 | -163.23 | 3 | 12 | -2 | 186 | 454.357 | 6 | ↓ |
| Hi High (pH 8-9.5) | 0.42 | -0.97 | -222.88 | 2 | 12 | -3 | 189 | 453.349 | 6 | ↓ |
| Mid Mid (pH 6-8) | -0.04 | -0.05 | -68.69 | 4 | 12 | -1 | 183 | 455.365 | 6 | ↓ |
