In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 24th, 2009 | 20 | No |
Popular Name: (E)-3-[5-(1,1-dioxo-1,4-thiazinan-4-yl)-1,3-dimethyl-pyrazol-4-yl]prop-2-enoic (E)-3-[5-(1,1-dioxo-1,4-thiazina…
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) | -0.18 | 2.77 | -71.72 | 1 | 7 | 0 | 97 | 299.352 | 3 | ↓ |
Mid Mid (pH 6-8) | -0.18 | 2.65 | -60.8 | 0 | 7 | -1 | 95 | 298.344 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.