| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 20th, 2010 | 22 | No |
Popular Name: (2Z)-7-(dimethylaminomethyl)-6-hydroxy-2-(2-pyridylmethylene)benzofuran-3-one (2Z)-7-(dimethylaminomethyl)-6-h…
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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) | 1.76 | 6.2 | -41.67 | 2 | 5 | 1 | 68 | 297.334 | 3 | ↓ |
| Hi High (pH 8-9.5) | 1.76 | 4.47 | -45.51 | 0 | 5 | -1 | 69 | 295.318 | 3 | ↓ |
| Mid Mid (pH 6-8) | 1.76 | 7.1 | -30.71 | 1 | 5 | 0 | 71 | 296.326 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
