General Information of the Compound
| Compound ID |
CP0542355
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| Compound Name |
7-[(4-chlorophenyl)methoxy]-4-(trifluoromethyl)chromen-2-one
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| Structure |
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| Formula |
C17H10ClF3O3
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| Molecular Weight |
354.711
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| Canonical SMILES |
FC(F)(F)c1cc(=O)oc2cc(OCc3ccc(Cl)cc3)ccc12
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| InChI |
InChI=1S/C17H10ClF3O3/c18-11-3-1-10(2-4-11)9-23-12-5-6-13-14(17(19,20)21)8-16(22)24-15(13)7-12/h1-8H,9H2
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| InChIKey |
GPSQCEZKVPLMMY-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