In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 29th, 2011 | 20 | Yes |
Popular Name: 5-[[4-(1,3-dioxolan-2-yl)-1-piperidyl]sulfonyl]pentanenitrile 5-[[4-(1,3-dioxolan-2-yl)-1-pipe…
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) | 0.53 | 3.85 | -16.59 | 0 | 6 | 0 | 80 | 302.396 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.