In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 31st, 2011 | 12 | No |
Popular Name: (2S,6S)-2,6-dimethyl-4-[[(2R)-oxiran-2-yl]methyl]thiomorpholine (2S,6S)-2,6-dimethyl-4-[[(2R)-ox…
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) | 1.29 | 4.91 | -38.06 | 1 | 2 | 1 | 17 | 188.316 | 2 | ↓ |
Mid Mid (pH 6-8) | 1.29 | 3.24 | -4.9 | 0 | 2 | 0 | 16 | 187.308 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.