| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 30th, 2009 | 12 | Yes |
Popular Name: 3(2H)-Isoxazolone, 5-(2-furanyl)-4-methyl- (9CI) 3(2H)-Isoxazolone, 5-(2-furanyl)…
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CAS Number: 210836-32-1
| 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) | 1.76 | 0.34 | -49.54 | 0 | 4 | -1 | 62 | 164.14 | 1 | ↓ |
| Lo Low (pH 4.5-6) | 1.31 | 2.02 | -8.59 | 1 | 4 | 0 | 59 | 165.148 | 1 | ↓ |
