In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 30th, 2011 | 15 | No |
Popular Name: (3R,4S)-4-[(3R)-3-methylthiomorpholin-4-yl]-1,1-dioxo-thiolan-3-ol (3R,4S)-4-[(3R)-3-methylthiomorp…
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) | -0.34 | -1.25 | -12.7 | 1 | 4 | 0 | 58 | 251.373 | 1 | ↓ |
Mid Mid (pH 6-8) | -0.34 | 0.47 | -48.15 | 2 | 4 | 1 | 59 | 252.381 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.