| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 16th, 2010 | 26 | Yes |
Popular Name: 8-(3-chloro-5-fluoro-benzoyl)-2-isopentyl-1,3,8-triazaspiro[4.5]dec-1-en-4-one 8-(3-chloro-5-fluoro-benzoyl)-2-…
| 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) | 2.95 | 7.35 | -18.13 | 1 | 5 | 0 | 62 | 379.863 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 2.95 | 8.06 | -45.74 | 2 | 5 | 1 | 63 | 380.871 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
![1,3,8-triazaspiro[4.5]dec-2-en-4-one](http://zinc12.docking.org/img/rings/373583.gif)
![8-benzoyl-1,3,8-triazaspiro[4.5]dec-2-en-4-one](http://zinc12.docking.org/img/rings/426887.gif)