| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 8th, 2011 | 21 | No |
Popular Name: 3-[(E)-(1,3-dioxo-4-isoquinolylidene)methyl]benzonitrile 3-[(E)-(1,3-dioxo-4-isoquinolyli…
| 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) | 2.42 | 6.38 | -12.43 | 1 | 4 | 0 | 74 | 274.279 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
