General Information of the Compound
| Compound ID |
CP0561944
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| Compound Name |
3-iodo-1-methyl-N-[2-oxo-4-(trifluoromethyl)chromen-7-yl]pyrazole-4-carboxamide
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| Structure |
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| Formula |
C15H9F3IN3O3
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| Molecular Weight |
463.153
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| Canonical SMILES |
Cn1cc(C(=O)Nc2ccc3c(cc(=O)oc3c2)C(F)(F)F)c(I)n1
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| InChI |
InChI=1S/C15H9F3IN3O3/c1-22-6-9(13(19)21-22)14(24)20-7-2-3-8-10(15(16,17)18)5-12(23)25-11(8)4-7/h2-6H,1H3,(H,20,24)
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| InChIKey |
ORDVJSQOQYETRI-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