General Information of the Compound
| Compound ID |
CP0559830
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| Compound Name |
N-[4-[2-fluoro-3-(trifluoromethyl)phenyl]-1,3-thiazol-2-yl]-4-(pyridin-3-ylamino)benzamide
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| Structure |
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| Formula |
C22H14F4N4OS
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| Molecular Weight |
458.44
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| Canonical SMILES |
Fc1c(cccc1C(F)(F)F)-c1csc(NC(=O)c2ccc(Nc3cccnc3)cc2)n1
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| InChI |
InChI=1S/C22H14F4N4OS/c23-19-16(4-1-5-17(19)22(24,25)26)18-12-32-21(29-18)30-20(31)13-6-8-14(9-7-13)28-15-3-2-10-27-11-15/h1-12,28H,(H,29,30,31)
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| InChIKey |
HRAHRSXQOVQKST-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