| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 5th, 2011 | 24 | Yes |
Popular Name: N-[[3-(dimethylamino)phenyl]methyl]-4-oxo-1H-quinoline-2-carboxamide N-[[3-(dimethylamino)phenyl]meth…
| 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) | 1.78 | 6.83 | -11.38 | 2 | 5 | 0 | 65 | 321.38 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 1.78 | 7.61 | -25.24 | 3 | 5 | 0 | 66 | 322.388 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
