General Information of the Compound
| Compound ID |
CP0254276
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| Compound Name |
5-(2,3-dimethoxyphenyl)-3-(3-(3-fluoro-4-methoxyphenyl)-4,5-dihydroisoxazol-5-yl)-1,2,4-oxadiazol
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| Structure |
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| Formula |
C20H18FN3O5
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| Molecular Weight |
399.378
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| Canonical SMILES |
COc1ccc(cc1F)C1=NOC(C1)c1noc(n1)-c1cccc(OC)c1OC
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| InChI |
InChI=1S/C20H18FN3O5/c1-25-15-8-7-11(9-13(15)21)14-10-17(28-23-14)19-22-20(29-24-19)12-5-4-6-16(26-2)18(12)27-3/h4-9,17H,10H2,1-3H3
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| InChIKey |
JIMSLYLACPDQDA-UHFFFAOYSA-N
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| Physicochemical Property |
"RO5" indicates the cutoff set by lipinski's rule of five: (1) Molecular weight less than 500 Dalton; (2) xlogp less than 5; (3) No more than 5 hbonddonor (Hydrogen Bond Donor Count); (4) No more than 10 hbondacc (Hydrogen Bond Acceptor Count); (5) No more than 10 rotbonds (Rotatable Bond Count). Show/Hide
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Map of Molecular Bioactivity Related to the Compound
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Map of Molecular Bioactivity Related to the Compound Compound Cell Line Protein Bioactivity Value: <= 0.1 μM > 0.1 μM and <= 10 μM > 10 μM Imprecise Activity |
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Table of Molecular Bioactivities Related to the Compound