| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 18th, 2008 | 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) | 3.64 | 12.24 | -72.14 | 1 | 7 | 0 | 82 | 466.969 | 8 | ↓ |
| Hi High (pH 8-9.5) | 3.64 | 9.93 | -62.23 | 0 | 7 | -1 | 81 | 465.961 | 8 | ↓ |
| Lo Low (pH 4.5-6) | 3.64 | 11.42 | -53.04 | 2 | 7 | 1 | 79 | 467.977 | 8 | ↓ |
