| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 5th, 2010 | 17 | No |
Popular Name: 4-Isoxazolecarboxylic acid, 3-[4-(chloromethyl)phenyl]-, methyl ester (9CI) 4-Isoxazolecarboxylic acid, 3-[4…
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CAS Number: 839718-03-5
| 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) | 2.43 | 6.93 | -9.38 | 0 | 4 | 0 | 52 | 251.669 | 4 | ↓ |
