| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 1st, 2009 | 30 | 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) | 2.71 | 5.92 | -67.32 | 4 | 6 | 0 | 102 | 448.61 | 13 | ↓ |
| Hi High (pH 8-9.5) | 2.71 | 4.55 | -41.19 | 3 | 6 | -1 | 97 | 447.602 | 13 | ↓ |
