General Information of the Compound
| Compound ID |
CP0411153
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| Compound Name |
3-fluoro-7-hydroxy-4-((6-methylpyridin-2-ylthio)methyl)-2H-chromen-2-one
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| Structure |
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| Formula |
C16H12FNO3S
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| Molecular Weight |
317.341
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| Canonical SMILES |
Cc1cccc(SCc2c(F)c(=O)oc3cc(O)ccc23)n1
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| InChI |
InChI=1S/C16H12FNO3S/c1-9-3-2-4-14(18-9)22-8-12-11-6-5-10(19)7-13(11)21-16(20)15(12)17/h2-7,19H,8H2,1H3
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| InChIKey |
RQRXXGGHFHNKDM-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