In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 27th, 2010 | 15 | No |
Popular Name: (1S,2R)-2-[(1-oxo-1,4-thiazinan-4-yl)methyl]cyclohexanol (1S,2R)-2-[(1-oxo-1,4-thiazinan-…
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 | 0.67 | -11.5 | 1 | 3 | 0 | 41 | 231.361 | 2 | ↓ |
Mid Mid (pH 6-8) | 0.34 | 2.51 | -48.11 | 2 | 3 | 1 | 42 | 232.369 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.