| 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) | 0.06 | 11.04 | -73.24 | 2 | 9 | -1 | 151 | 514.308 | 6 | ↓ |
| Hi High (pH 8-9.5) | 0.06 | 10.12 | -124.68 | 1 | 9 | -2 | 147 | 513.3 | 6 | ↓ |
| Mid Mid (pH 6-8) | 0.06 | 9.04 | -44.33 | 3 | 9 | 0 | 148 | 515.316 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 0.06 | 8.66 | -48.89 | 3 | 9 | 0 | 148 | 515.316 | 6 | ↓ |
