| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 15th, 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) | 4.44 | 7.94 | -12.71 | 2 | 7 | 0 | 88 | 435.524 | 8 | ↓ |
| Hi High (pH 8-9.5) | 4.21 | 8.3 | -57.65 | 0 | 7 | -1 | 87 | 434.516 | 8 | ↓ |
| Hi High (pH 8-9.5) | 4.21 | 8.6 | -55.49 | 0 | 7 | -1 | 87 | 434.516 | 8 | ↓ |
| Hi High (pH 8-9.5) | 4.44 | 8.91 | -49.96 | 1 | 7 | -1 | 91 | 434.516 | 8 | ↓ |
