In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 20th, 2011 | 18 | No |
Popular Name: (3R,4R)-4-(4,4-diethyl-1-piperidyl)-1,1-dioxo-thiolan-3-ol (3R,4R)-4-(4,4-diethyl-1-piperid…
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) | 1.18 | 1.67 | -45.98 | 2 | 4 | 1 | 59 | 276.422 | 3 | ↓ |
Hi High (pH 8-9.5) | 1.18 | -0.54 | -10.73 | 1 | 4 | 0 | 58 | 275.414 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.