| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 5th, 2010 | 18 | Yes |
Popular Name: 4-Isoxazolecarboxylic acid, 3-(2,4,6-trimethylphenyl)-, methyl ester (9CI) 4-Isoxazolecarboxylic acid, 3-(2…
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CAS Number: 267651-91-2
| 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) | 3.06 | 7.24 | -9.54 | 0 | 4 | 0 | 52 | 245.278 | 3 | ↓ |
