| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 3rd, 2012 | 52 | 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) | 8.73 | 15.25 | -110.84 | 10 | 10 | 2 | 172 | 739.188 | 39 | ↓ |
| Hi High (pH 8-9.5) | 8.73 | 14.61 | -25.76 | 8 | 10 | 0 | 168 | 737.172 | 39 | ↓ |
| Mid Mid (pH 6-8) | 8.73 | 14.95 | -63.89 | 9 | 10 | 1 | 170 | 738.18 | 39 | ↓ |
