| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 21st, 2010 | 34 | No |
Popular Name: [(2Z)-2-[(3-fluorophenyl)methylene]-6-hydroxy-3-oxo-benzofuran-7-yl]methylBLAHone [(2Z)-2-[(3-fluorophenyl)methyle…
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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) | 3.59 | 11.93 | -62.32 | 2 | 6 | 1 | 77 | 459.497 | 3 | ↓ |
| Hi High (pH 8-9.5) | 3.59 | 10.37 | -41.72 | 0 | 6 | -1 | 79 | 457.481 | 3 | ↓ |
| Mid Mid (pH 6-8) | 3.59 | 12.51 | -35.03 | 1 | 6 | 0 | 80 | 458.489 | 3 | ↓ |
| Mid Mid (pH 6-8) | 3.59 | 9.79 | -20.31 | 1 | 6 | 0 | 76 | 458.489 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
