| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 15th, 2010 | 28 | 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) | 4.97 | 9.08 | -9.94 | 2 | 5 | 0 | 69 | 438.325 | 4 | ↓ |
| Hi High (pH 8-9.5) | 4.74 | 9.72 | -41.65 | 0 | 5 | -1 | 68 | 437.317 | 4 | ↓ |
| Hi High (pH 8-9.5) | 4.74 | 9.27 | -50.18 | 0 | 5 | -1 | 68 | 437.317 | 4 | ↓ |
| Hi High (pH 8-9.5) | 4.97 | 9.89 | -34.84 | 1 | 5 | -1 | 72 | 437.317 | 4 | ↓ |
