| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 20th, 2010 | 25 | 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) | 2.37 | 7.17 | -43.19 | 2 | 5 | 1 | 49 | 340.447 | 7 | ↓ |
| Hi High (pH 8-9.5) | 2.37 | 5.82 | -9.19 | 1 | 5 | 0 | 45 | 339.439 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 2.37 | 8.04 | -40.97 | 2 | 5 | 1 | 46 | 340.447 | 7 | ↓ |
