| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 27th, 2010 | 17 | No |
Popular Name: N-[[(3R)-1,1-dioxothiolan-3-yl]methyl]-2-(2-methylimidazol-1-yl)ethanamine N-[[(3R)-1,1-dioxothiolan-3-yl]m…
| 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) | -0.58 | 3.3 | -77.01 | 2 | 5 | 1 | 69 | 258.367 | 5 | ↓ |
| Mid Mid (pH 6-8) | -0.58 | 3.77 | -128.43 | 3 | 5 | 2 | 70 | 259.375 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
