In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 23rd, 2011 | 27 | Yes |
Popular Name: N-[4-(4-methoxyphenyl)isoxazol-5-yl]-2-oxo-3H-1,3-benzoxazole-6-sulfonamide N-[4-(4-methoxyphenyl)isoxazol-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) | 2.31 | 0.89 | -45.6 | 1 | 9 | -1 | 130 | 386.365 | 5 | ↓ |
Hi High (pH 8-9.5) | 2.76 | -1.74 | -95.35 | 0 | 9 | -2 | 133 | 385.357 | 5 | ↓ |
Lo Low (pH 4.5-6) | 2.31 | 1.58 | -15.43 | 2 | 9 | 0 | 127 | 387.373 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.