| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 19th, 2009 | 33 | Yes |
None
| 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) | 2.90 | 4.75 | -15.75 | 3 | 8 | 0 | 112 | 462.893 | 5 | ↓ |
| Hi High (pH 8-9.5) | 2.90 | 5.58 | -38.96 | 2 | 8 | -1 | 114 | 461.885 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 2.70 | 4.61 | -47.77 | 3 | 8 | 1 | 109 | 463.901 | 5 | ↓ |
