| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 14th, 2004 | 33 | 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) | 4.89 | 8.93 | -13 | 3 | 6 | 0 | 89 | 439.515 | 4 | ↓ |
| Hi High (pH 8-9.5) | 4.66 | 9.12 | -56.31 | 1 | 6 | -1 | 88 | 438.507 | 4 | ↓ |
| Hi High (pH 8-9.5) | 4.66 | 9.32 | -46.63 | 1 | 6 | -1 | 88 | 438.507 | 4 | ↓ |
| Hi High (pH 8-9.5) | 4.89 | 9.8 | -47.12 | 2 | 6 | -1 | 92 | 438.507 | 4 | ↓ |
