| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 21st, 2010 | 36 | No |
Popular Name: [(2E)-6-hydroxy-2-[(4-nitrophenyl)methylene]-3-oxo-benzofuran-7-yl]methylBLAHone [(2E)-6-hydroxy-2-[(4-nitropheny…
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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) | 3.41 | 10.36 | -22.55 | 1 | 9 | 0 | 122 | 485.496 | 4 | ↓ |
| Hi High (pH 8-9.5) | 3.41 | 10.95 | -43.06 | 0 | 9 | -1 | 124 | 484.488 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
