General Information of the Compound
| Compound ID |
CP0542357
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| Compound Name |
7-(pyridin-2-ylmethoxy)-4-(trifluoromethyl)chromen-2-one
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| Structure |
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| Formula |
C16H10F3NO3
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| Molecular Weight |
321.254
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| Canonical SMILES |
FC(F)(F)c1cc(=O)oc2cc(OCc3ccccn3)ccc12
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| InChI |
InChI=1S/C16H10F3NO3/c17-16(18,19)13-8-15(21)23-14-7-11(4-5-12(13)14)22-9-10-3-1-2-6-20-10/h1-8H,9H2
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| InChIKey |
SJDRTAKZOJRNDR-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