| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 19th, 2011 | 23 | No |
Popular Name: 3-[1-[(5R)-3,5-dimethyl-4H-isoxazole-5-carbonyl]-4-piperidyl]-4-ethyl-1H-1,2,4-triazol-5-one 3-[1-[(5R)-3,5-dimethyl-4H-isoxa…
| 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) | 0.14 | 4.96 | -15.6 | 1 | 8 | 0 | 93 | 321.381 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
![3-[1-(2-isoxazoline-5-carbonyl)-4-piperidyl]-1,4-dihydro-1,2,4-triazol-5-one](http://zinc12.docking.org/img/rings/611580.gif)