In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 27th, 2010 | 20 | Yes |
Popular Name: (2S,4R)-4-tert-butyl-2-[[(2S,6R)-2,6-dimethylmorpholin-4-yl]methyl]cyclohexanone (2S,4R)-4-tert-butyl-2-[[(2S,6R)…
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) | 3.20 | 6.82 | -5.4 | 0 | 3 | 0 | 30 | 281.44 | 3 | ↓ |
Mid Mid (pH 6-8) | 3.20 | 8.86 | -40.26 | 1 | 3 | 1 | 31 | 282.448 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.