General Information of the Compound
| Compound ID |
CP0254281
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| Compound Name |
3-(3-(3-(3-fluoro-4-hydroxyphenyl)-4,5-dihydroisoxazol-5-yl)-1,2,4-oxadiazol-5-yl)benzene-1-2-diol
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| Structure |
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| Formula |
C17H12FN3O5
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| Molecular Weight |
357.297
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| Canonical SMILES |
Oc1ccc(cc1F)C1=NOC(C1)c1noc(n1)-c1cccc(O)c1O
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| InChI |
InChI=1S/C17H12FN3O5/c18-10-6-8(4-5-12(10)22)11-7-14(25-20-11)16-19-17(26-21-16)9-2-1-3-13(23)15(9)24/h1-6,14,22-24H,7H2
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| InChIKey |
HGAIFEYVWWLSNQ-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