| 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) | 2.62 | 7.84 | -44.42 | 4 | 6 | 1 | 82 | 431.56 | 3 | ↓ |
| Hi High (pH 8-9.5) | 2.62 | 5.72 | -13.14 | 3 | 6 | 0 | 81 | 430.552 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 2.62 | 8.31 | -87.08 | 5 | 6 | 2 | 84 | 432.568 | 3 | ↓ |
