In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 26th, 2009 | 18 | No |
Popular Name: 2-[1-(1,1-dioxothian-4-yl)imidazol-2-yl]sulfanylacetic 2-[1-(1,1-dioxothian-4-yl)imidaz…
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) | -0.05 | 4.26 | -51.78 | 0 | 6 | -1 | 92 | 289.358 | 4 | ↓ |
Mid Mid (pH 6-8) | -0.05 | 4.75 | -52.85 | 1 | 6 | 0 | 93 | 290.366 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.