| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 12th, 2011 | 45 | 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) | 2.68 | 1.64 | -103.38 | 9 | 9 | 2 | 146 | 641.979 | 24 | ↓ |
| Mid Mid (pH 6-8) | 2.68 | -0.72 | -61.14 | 8 | 9 | 1 | 144 | 640.971 | 24 | ↓ |
| Mid Mid (pH 6-8) | 2.68 | 1.54 | -133.03 | 9 | 9 | 2 | 146 | 641.979 | 24 | ↓ |
| Lo Low (pH 4.5-6) | 2.68 | 4.79 | -212.92 | 10 | 9 | 3 | 147 | 642.987 | 24 | ↓ |
