General Information of the Compound
| Compound ID |
CP0195513
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| Compound Name |
4-(2-fluoro-4-(1-phenyl-5-(trifluoromethyl)-1H-pyrazole-4-carboxamido)phenoxy)-N-methylpicolinamide
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| Structure |
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| Formula |
C24H17F4N5O3
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| Molecular Weight |
499.424
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| Canonical SMILES |
CNC(=O)c1cc(Oc2ccc(NC(=O)c3cnn(c3C(F)(F)F)-c3ccccc3)cc2F)ccn1
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| InChI |
InChI=1S/C24H17F4N5O3/c1-29-23(35)19-12-16(9-10-30-19)36-20-8-7-14(11-18(20)25)32-22(34)17-13-31-33(21(17)24(26,27)28)15-5-3-2-4-6-15/h2-13H,1H3,(H,29,35)(H,32,34)
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| InChIKey |
QZPVUNCPIWFBDX-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