In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 30th, 2011 | 16 | No |
Popular Name: (2R)-2-cyclohexyl-2-[(3R)-3-methylthiomorpholin-4-yl]ethanamine (2R)-2-cyclohexyl-2-[(3R)-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) | 2.14 | 4.26 | -48.15 | 3 | 2 | 1 | 31 | 243.44 | 3 | ↓ |
Mid Mid (pH 6-8) | 2.14 | 6.02 | -128.38 | 4 | 2 | 2 | 32 | 244.448 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.