| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 5th, 2009 | 26 | 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) | -4.84 | 1.25 | -121.76 | 4 | 11 | -1 | 177 | 422.32 | 8 | ↓ |
| Mid Mid (pH 6-8) | -4.84 | 2.36 | -224.66 | 3 | 11 | -2 | 180 | 421.312 | 8 | ↓ |
| Lo Low (pH 4.5-6) | -4.84 | 1.7 | -163.75 | 5 | 11 | 0 | 179 | 423.328 | 8 | ↓ |
