| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 27th, 2010 | 18 | Yes |
Popular Name: (2S,4R)-4-ethyl-2-[[methyl(thiazol-4-ylmethyl)amino]methyl]cyclohexanone (2S,4R)-4-ethyl-2-[[methyl(thiaz…
| 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) | 2.56 | 8.12 | -37.81 | 1 | 3 | 1 | 34 | 267.418 | 5 | ↓ |
| Mid Mid (pH 6-8) | 2.56 | 5.93 | -6.8 | 0 | 3 | 0 | 33 | 266.41 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
![2-[(thiazol-4-ylmethylamino)methyl]cyclohexanone](http://zinc12.docking.org/img/rings/116643.gif)