In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 25th, 2007 | 21 | No |
Popular Name: N-(1,1-dioxothiolan-3-yl)-2-(2-methylsulfonylaminothiazol-4-yl)-acetamide N-(1,1-dioxothiolan-3-yl)-2-(2-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) | -0.73 | -11.13 | -29.05 | 2 | 8 | 0 | 122 | 353.447 | 5 | ↓ |
Hi High (pH 8-9.5) | -0.73 | -10.58 | -57.43 | 1 | 8 | -1 | 124 | 352.439 | 5 | ↓ |
Mid Mid (pH 6-8) | 0.20 | -2.32 | -31.81 | 2 | 8 | 0 | 126 | 353.447 | 4 | ↓ |
Mid Mid (pH 6-8) | 0.20 | -2.24 | -28.32 | 2 | 8 | 0 | 126 | 353.447 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.