| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 21st, 2010 | 35 | No |
Popular Name: [(2Z)-2-[(3-fluorophenyl)methylene]-6-hydroxy-4-methyl-3-oxo-benzofuran-7-yl]methylBLAHone [(2Z)-2-[(3-fluorophenyl)methyle…
None
None
| 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) | 3.97 | 12.6 | -60.53 | 2 | 6 | 1 | 77 | 473.524 | 3 | ↓ |
| Hi High (pH 8-9.5) | 3.97 | 11.04 | -42.06 | 0 | 6 | -1 | 79 | 471.508 | 3 | ↓ |
| Mid Mid (pH 6-8) | 3.97 | 10.46 | -19.19 | 1 | 6 | 0 | 76 | 472.516 | 3 | ↓ |
| Mid Mid (pH 6-8) | 3.97 | 13.18 | -33.74 | 1 | 6 | 0 | 80 | 472.516 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
