| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 14th, 2011 | 27 | Yes |
Popular Name: 7-methyl-3-[3-(m-tolyl)-1H-pyrazole-4-carbonyl]-3,7,10-triazaspiro[5.5]undecan-11-one 7-methyl-3-[3-(m-tolyl)-1H-pyraz…
None
| 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) | 0.77 | 5.38 | -60.6 | 3 | 7 | 1 | 83 | 368.461 | 2 | ↓ |
| Mid Mid (pH 6-8) | 0.77 | 3.06 | -12.45 | 2 | 7 | 0 | 81 | 367.453 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
![1,4,9-triazaspiro[5.5]undecan-5-one](http://zinc12.docking.org/img/rings/373598.gif)
![9-(3-phenyl-1H-pyrazole-4-carbonyl)-1,4,9-triazaspiro[5.5]undecan-5-one](http://zinc12.docking.org/img/rings/578596.gif)