In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
June 13th, 2008 | 24 | No |
Popular Name: (E)-3-[3-nitro-4-([1,2,4]triazolo[4,5-a]pyridin-3-ylsulfanyl)phenyl]prop-2-enoic (E)-3-[3-nitro-4-([1,2,4]triazol…
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) | 3.08 | 9.59 | -62.49 | 0 | 8 | -1 | 116 | 341.328 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.