| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 5th, 2010 | 17 | Yes |
Popular Name: 4-Isoxazolecarboxylic acid, 5-methyl-3-(phenylmethyl)-, methyl ester (9CI) 4-Isoxazolecarboxylic acid, 5-me…
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CAS Number: 321885-01-2
| 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) | 2.60 | 7.42 | -7.85 | 0 | 4 | 0 | 52 | 231.251 | 4 | ↓ |
