| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 20th, 2011 | 19 | Yes |
Popular Name: 3-[2-[(3,5-dimethylisoxazol-4-yl)methyl-methyl-amino]ethyl]-4-methyl-thiazol-2-one 3-[2-[(3,5-dimethylisoxazol-4-yl…
| 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) | 0.89 | 6.63 | -54.29 | 1 | 5 | 1 | 52 | 282.389 | 5 | ↓ |
| Mid Mid (pH 6-8) | 0.89 | 4.3 | -13.64 | 0 | 5 | 0 | 51 | 281.381 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
![3-[2-(isoxazol-4-ylmethylamino)ethyl]-4-thiazolin-2-one](http://zinc12.docking.org/img/rings/296095.gif)