General Information of the Compound
Compound ID |
CP0552963
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Compound Name |
4-[[4-chloro-2-fluoro-6-[3-fluoro-2-methoxy-4-(trifluoromethoxy)phenoxy]-3-methylbenzoyl]amino]pyridine-2-carboxamide
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Structure |
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Formula |
C22H15ClF5N3O5
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Molecular Weight |
531.821
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Canonical SMILES |
COc1c(F)c(OC(F)(F)F)ccc1Oc1cc(Cl)c(C)c(F)c1C(=O)Nc1ccnc(c1)C(N)=O
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InChI |
InChI=1S/C22H15ClF5N3O5/c1-9-11(23)8-15(35-14-4-3-13(36-22(26,27)28)18(25)19(14)34-2)16(17(9)24)21(33)31-10-5-6-30-12(7-10)20(29)32/h3-8H,1-2H3,(H2,29,32)(H,30,31,33)
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InChIKey |
RLZFZNTUHCVLMN-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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ChEMBL ID |
Map of Molecular Bioactivity Related to the Compound
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