General Information of the Compound
| Compound ID |
CP0476361
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| Compound Name |
6-[3-(trifluoromethyl)phenyl]chromen-2-one
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| Structure |
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| Formula |
C16H9F3O2
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| Molecular Weight |
290.24
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| Canonical SMILES |
FC(F)(F)c1cccc(c1)-c1ccc2oc(=O)ccc2c1
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| InChI |
InChI=1S/C16H9F3O2/c17-16(18,19)13-3-1-2-10(9-13)11-4-6-14-12(8-11)5-7-15(20)21-14/h1-9H
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| InChIKey |
GSIXGPWONSTSCY-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