General Information of the Compound
| Compound ID |
CP0305782
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| Compound Name |
3-(3-(3-(3-fluoro-4-methoxyphenyl)-4,5-dihydroisoxazole-5-yl)-1,2,4-oxadaizole-5-yl)propanoic acid
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| Structure |
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| Formula |
C15H14FN3O5
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| Molecular Weight |
335.291
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| Canonical SMILES |
COc1ccc(cc1F)C1=NOC(C1)c1noc(CCC(O)=O)n1
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| InChI |
InChI=1S/C15H14FN3O5/c1-22-11-3-2-8(6-9(11)16)10-7-12(23-18-10)15-17-13(24-19-15)4-5-14(20)21/h2-3,6,12H,4-5,7H2,1H3,(H,20,21)
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| InChIKey |
JSNHKQSIZKMVAU-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