In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 1st, 2011 | 23 | Yes |
Popular Name: 2-(1,1-dioxo-1,2-thiazolidin-2-yl)-1-[(3S)-3-(2-ethylimidazol-1-yl)-1-piperidyl]ethanone 2-(1,1-dioxo-1,2-thiazolidin-2-y…
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) | -0.07 | 5.33 | -41.15 | 1 | 7 | 1 | 77 | 341.457 | 4 | ↓ |
Mid Mid (pH 6-8) | -0.07 | 4.87 | -23.21 | 0 | 7 | 0 | 76 | 340.449 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.