| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 27th, 2010 | 18 | No |
Popular Name: (1S,2S,4R)-2-[[[(3R)-1,1-dioxothiolan-3-yl]-methyl-amino]methyl]-4-methyl-cyclohexanol (1S,2S,4R)-2-[[[(3R)-1,1-dioxoth…
| 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) | 1.01 | 2.73 | -53.32 | 2 | 4 | 1 | 59 | 276.422 | 3 | ↓ |
| Mid Mid (pH 6-8) | 1.01 | 0.77 | -10.79 | 1 | 4 | 0 | 58 | 275.414 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
