| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 6th, 2009 | 11 | Yes |
| 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) | -4.17 | -7.97 | -46.5 | 8 | 6 | 1 | 126 | 161.185 | 4 | ↓ |
| Hi High (pH 8-9.5) | -4.17 | -8.35 | -7.93 | 7 | 6 | 0 | 124 | 160.177 | 4 | ↓ |
| Lo Low (pH 4.5-6) | -4.17 | -7.59 | -131.82 | 9 | 6 | 2 | 127 | 162.193 | 4 | ↓ |
