| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 9th, 2010 | 32 | 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) | 3.34 | 8.58 | -44.01 | 4 | 6 | 1 | 83 | 434.56 | 3 | ↓ |
| Hi High (pH 8-9.5) | 3.34 | 6.46 | -12.55 | 3 | 6 | 0 | 81 | 433.552 | 3 | ↓ |
