| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 5th, 2010 | 17 | Yes |
Popular Name: 4-Isoxazolecarboxylic acid, 3-(3-cyanophenyl)-, methyl ester (9CI) 4-Isoxazolecarboxylic acid, 3-(3…
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CAS Number: 209731-38-4
| 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) | 1.59 | 6.03 | -10.51 | 0 | 5 | 0 | 76 | 228.207 | 3 | ↓ |
