| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 6th, 2011 | 20 | No |
Popular Name: 9-acetyl-4-oxo-2-sulfanyl-3,9-diazaspiro[5.5]undec-1-ene-1,5-dicarbonitrile 9-acetyl-4-oxo-2-sulfanyl-3,9-di…
| 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) | -0.85 | 1.4 | -20.33 | 0 | 6 | 0 | 103 | 289.34 | 0 | ↓ |
| Lo Low (pH 4.5-6) | -1.04 | 3.29 | -17.97 | 1 | 6 | 0 | 97 | 290.348 | 0 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
![3,9-diazaspiro[5.5]undec-3-ene-2-thione](http://zinc12.docking.org/img/rings/159493.gif)