In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 4th, 2011 | 20 | Yes |
Popular Name: 2-(5-butyl-1,3-dioxan-2-yl)thieno[2,3-b]thiophene-5-carbonitrile 2-(5-butyl-1,3-dioxan-2-yl)thien…
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) | 4.99 | 8.96 | -5.5 | 0 | 3 | 0 | 42 | 307.44 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.