| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 12th, 2008 | 21 | 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) | 2.66 | 5.42 | -36.73 | 2 | 4 | 1 | 37 | 356.284 | 3 | ↓ |
| Hi High (pH 8-9.5) | 2.66 | 4.46 | -44.41 | 0 | 4 | -1 | 39 | 354.268 | 3 | ↓ |
| Hi High (pH 8-9.5) | 2.66 | 3.7 | -5.52 | 1 | 4 | 0 | 36 | 355.276 | 3 | ↓ |
| Hi High (pH 8-9.5) | 2.66 | 6.18 | -60.72 | 1 | 4 | 0 | 40 | 355.276 | 3 | ↓ |
