| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 21st, 2010 | 36 | No |
Popular Name: [(2E)-2-[(4-dimethylaminophenyl)methylene]-6-hydroxy-3-oxo-benzofuran-7-yl]methylBLAHone [(2E)-2-[(4-dimethylaminophenyl)…
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| 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) | 3.55 | 11.84 | -51.24 | 2 | 7 | 1 | 80 | 484.576 | 4 | ↓ |
| Hi High (pH 8-9.5) | 3.55 | 10.46 | -59.98 | 0 | 7 | -1 | 82 | 482.56 | 4 | ↓ |
| Mid Mid (pH 6-8) | 3.55 | 12.6 | -51.19 | 1 | 7 | 0 | 83 | 483.568 | 4 | ↓ |
| Mid Mid (pH 6-8) | 3.55 | 9.7 | -15.41 | 1 | 7 | 0 | 79 | 483.568 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 3.55 | 12.6 | -81.82 | 3 | 7 | 0 | 81 | 485.584 | 4 | ↓ |
