In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 30th, 2010 | 20 | Yes |
Popular Name: N-(5-cyano-2-methyl-phenyl)-3,5-dimethyl-isoxazole-4-sulfonamide N-(5-cyano-2-methyl-phenyl)-3,5-…
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) | 1.69 | 4.18 | -36.82 | 0 | 6 | -1 | 98 | 290.324 | 3 | ↓ |
Mid Mid (pH 6-8) | 1.69 | 3.81 | -13.15 | 1 | 6 | 0 | 96 | 291.332 | 3 | ↓ |