In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 11th, 2011 | 25 | No |
Popular Name: 2-allylsulfonyl-N-[4-(2-oxo-3H-1,3-benzoxazol-6-yl)thiazol-2-yl]acetamide 2-allylsulfonyl-N-[4-(2-oxo-3H-1…
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) | 1.10 | 2.3 | -31.38 | 2 | 8 | 0 | 122 | 379.419 | 6 | ↓ |
Hi High (pH 8-9.5) | 1.56 | -0.32 | -68.06 | 1 | 8 | -1 | 125 | 378.411 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.