| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 20th, 2010 | 22 | Yes |
Popular Name: 4-(4-dimethylaminophenyl)-2-oxo-5,6,7,8-tetrahydro-1H-quinoline-3-carbonitrile 4-(4-dimethylaminophenyl)-2-oxo-…
| 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) | 3.29 | 7.92 | -15.84 | 1 | 4 | 0 | 60 | 293.37 | 2 | ↓ |
| Hi High (pH 8-9.5) | 3.75 | 6.04 | -51.48 | 0 | 4 | -1 | 63 | 292.362 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
