| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 1st, 2009 | 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) | -1.52 | 4.39 | -52.45 | 4 | 12 | 0 | 190 | 457.395 | 6 | ↓ |
| Hi High (pH 8-9.5) | -1.52 | 2.12 | -48.88 | 3 | 12 | -1 | 185 | 456.387 | 6 | ↓ |
| Mid Mid (pH 6-8) | -1.52 | 3.41 | -55.48 | 3 | 12 | -1 | 185 | 456.387 | 6 | ↓ |
