In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 13th, 2009 | 22 | Yes |
Popular Name: 4-(5-Methyl-3-phenylisoxazol-4-yl)benzenesulfonic acid 4-(5-Methyl-3-phenylisoxazol-4-y…
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CAS Number: 181696-35-5
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) | 1.03 | 5.62 | -44.5 | 0 | 5 | -1 | 83 | 314.342 | 3 | ↓ |