| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 18th, 2009 | 23 | 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) | 2.47 | 5.15 | -60.74 | 4 | 5 | 1 | 83 | 336.481 | 7 | ↓ |
| Hi High (pH 8-9.5) | 2.47 | 3.73 | -14.82 | 3 | 5 | 0 | 78 | 335.473 | 7 | ↓ |
| Hi High (pH 8-9.5) | 2.93 | 4.12 | -48.74 | 3 | 5 | 0 | 86 | 335.473 | 7 | ↓ |
