| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 23rd, 2011 | 42 | 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) | 5.45 | 16.87 | -48.76 | 2 | 6 | 1 | 61 | 555.702 | 4 | ↓ |
| Hi High (pH 8-9.5) | 5.45 | 14.64 | -9.81 | 1 | 6 | 0 | 60 | 554.694 | 4 | ↓ |
