| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 30th, 2011 | 16 | No |
Popular Name: (2R,4R)-4-methyl-2-[[(3S)-3-methylthiomorpholin-4-yl]methyl]cyclohexanone (2R,4R)-4-methyl-2-[[(3S)-3-meth…
| 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) | 2.02 | 8 | -36.48 | 1 | 2 | 1 | 22 | 242.408 | 2 | ↓ |
| Mid Mid (pH 6-8) | 2.02 | 6.91 | -5.28 | 0 | 2 | 0 | 20 | 241.4 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
