| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 22nd, 2008 | 26 | No |
Popular Name: (2E)-6-hydroxy-7-[(4-methylpiperazin-1-yl)methyl]-2-(3-pyridylmethylene)benzofuran-3-one (2E)-6-hydroxy-7-[(4-methylpiper…
| 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) | 1.58 | 5.1 | -42.52 | 2 | 6 | 1 | 71 | 352.414 | 3 | ↓ |
| Hi High (pH 8-9.5) | 1.58 | 2.74 | -8.59 | 1 | 6 | 0 | 70 | 351.406 | 3 | ↓ |
| Hi High (pH 8-9.5) | 1.58 | 5.87 | -52.46 | 1 | 6 | 0 | 74 | 351.406 | 3 | ↓ |
| Hi High (pH 8-9.5) | 1.58 | 3.5 | -41.22 | 0 | 6 | -1 | 73 | 350.398 | 3 | ↓ |
