| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 29th, 2009 | 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) | 2.83 | 6.21 | -25 | 2 | 9 | 0 | 120 | 474.564 | 7 | ↓ |
| Hi High (pH 8-9.5) | 2.90 | 5.38 | -107.22 | 0 | 9 | -2 | 128 | 472.548 | 7 | ↓ |
| Hi High (pH 8-9.5) | 2.83 | 6.28 | -57.63 | 1 | 9 | -1 | 122 | 473.556 | 7 | ↓ |
| Hi High (pH 8-9.5) | 2.90 | 5.31 | -52.22 | 1 | 9 | -1 | 126 | 473.556 | 7 | ↓ |
