| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 24th, 2009 | 21 | No |
Popular Name: 2-(1,3-dioxo-4H-isoquinolin-2-yl)-6-fluoro-benzonitrile 2-(1,3-dioxo-4H-isoquinolin-2-yl…
| 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) | 2.21 | 8.52 | -15.96 | 0 | 4 | 0 | 61 | 280.258 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
