In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 31st, 2011 | 14 | No |
Popular Name: (2R)-2-[(2S,6R)-2,6-dimethylthiomorpholin-4-yl]cyclopentanone (2R)-2-[(2S,6R)-2,6-dimethylthio…
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) | 1.52 | 7.5 | -35.85 | 1 | 2 | 1 | 22 | 214.354 | 1 | ↓ |
Mid Mid (pH 6-8) | 1.52 | 5.42 | -5.47 | 0 | 2 | 0 | 20 | 213.346 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.