| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 27th, 2008 | 34 | No |
| 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) | 4.53 | 8.26 | -23.96 | 2 | 8 | 0 | 112 | 476.558 | 6 | ↓ |
| Ref Reference (pH 7) | 4.35 | 8.27 | -45.94 | 3 | 8 | 1 | 110 | 477.566 | 7 | ↓ |
| Hi High (pH 8-9.5) | 5.44 | 6.74 | -63.7 | 1 | 8 | -1 | 118 | 475.55 | 6 | ↓ |
| Hi High (pH 8-9.5) | 4.99 | 6.52 | -57.03 | 1 | 8 | -1 | 115 | 475.55 | 6 | ↓ |
| Hi High (pH 8-9.5) | 5.44 | 5.79 | -66.67 | 1 | 8 | -1 | 118 | 475.55 | 6 | ↓ |
