| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| June 29th, 2008 | 36 | 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) | 4.58 | 12.06 | -25.66 | 3 | 7 | 0 | 96 | 480.568 | 5 | ↓ |
| Hi High (pH 8-9.5) | 5.68 | 10.53 | -60.75 | 1 | 7 | -1 | 94 | 479.56 | 5 | ↓ |
| Hi High (pH 8-9.5) | 5.68 | 10.44 | -49.65 | 1 | 7 | -1 | 94 | 479.56 | 5 | ↓ |
| Hi High (pH 8-9.5) | 5.49 | 10.11 | -130.31 | 1 | 7 | -2 | 102 | 478.552 | 5 | ↓ |
