In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 14th, 2011 | 26 | Yes |
Popular Name: 6-[3-(4-ethoxyphenyl)propyl]-2,5-dioxo-1H-1,6-naphthyridine-3-carbonitrile 6-[3-(4-ethoxyphenyl)propyl]-2,5…
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) | 2.22 | 8.53 | -26.16 | 1 | 6 | 0 | 88 | 349.39 | 6 | ↓ |
Mid Mid (pH 6-8) | 3.12 | 6.55 | -52.5 | 0 | 6 | -1 | 91 | 348.382 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.