In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 18th, 2011 | 19 | Yes |
Popular Name: 2,5-dioxo-6-pentyl-1H-1,6-naphthyridine-3-carbonitrile 2,5-dioxo-6-pentyl-1H-1,6-naphth…
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) | 1.40 | 6.06 | -21.66 | 1 | 5 | 0 | 79 | 257.293 | 4 | ↓ |
Mid Mid (pH 6-8) | 2.31 | 4.08 | -48.31 | 0 | 5 | -1 | 82 | 256.285 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.