In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 21st, 2010 | 20 | No |
Popular Name: N-[[1-[(3-ethyl-2-thioxo-imidazol-1-yl)methyl]-4-piperidyl]methyl]acetamide N-[[1-[(3-ethyl-2-thioxo-imidazo…
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) | 0.36 | 6.68 | -22.5 | 1 | 5 | 0 | 42 | 296.44 | 5 | ↓ |
Mid Mid (pH 6-8) | 0.36 | 8.82 | -55.5 | 2 | 5 | 1 | 43 | 297.448 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.