| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 10th, 2010 | 26 | No |
Popular Name: 4-[3-[[(E)-(1,3-dioxo-4-isoquinolylidene)methyl]amino]phenoxy]butanenitrile 4-[3-[[(E)-(1,3-dioxo-4-isoquino…
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) | 2.32 | 7.37 | -19.03 | 2 | 6 | 0 | 95 | 347.374 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
