| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 11th, 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) | 2.43 | 8.94 | -100.18 | 5 | 7 | 0 | 119 | 448.445 | 3 | ↓ |
| Hi High (pH 8-9.5) | 2.43 | 8.66 | -60.18 | 4 | 7 | -1 | 117 | 447.437 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 1.63 | 6.92 | -86.22 | 6 | 7 | 0 | 122 | 449.453 | 3 | ↓ |
