| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 14th, 2011 | 23 | Yes |
Popular Name: 2,5-dioxo-6-[(3-propylisoxazol-5-yl)methyl]-1H-1,6-naphthyridine-3-carbonitrile 2,5-dioxo-6-[(3-propylisoxazol-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) | 1.98 | 4.05 | -57.58 | 0 | 7 | -1 | 108 | 309.305 | 4 | ↓ |
| Mid Mid (pH 6-8) | 1.08 | 6.03 | -32.63 | 1 | 7 | 0 | 105 | 310.313 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
