General Information of the Compound
| Compound ID |
CP0342498
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| Compound Name |
7-(2-fluoro-4-{[(1-phenylacetamido)methanethioyl]amino}phenoxy)thieno[3,2-b]pyridine-2-carboxamide
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| Structure |
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| Formula |
C23H17FN4O3S2
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| Molecular Weight |
480.546
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| Canonical SMILES |
NC(=O)c1cc2nccc(Oc3ccc(NC(=S)NC(=O)Cc4ccccc4)cc3F)c2s1
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| InChI |
InChI=1S/C23H17FN4O3S2/c24-15-11-14(27-23(32)28-20(29)10-13-4-2-1-3-5-13)6-7-17(15)31-18-8-9-26-16-12-19(22(25)30)33-21(16)18/h1-9,11-12H,10H2,(H2,25,30)(H2,27,28,29,32)
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| InChIKey |
YGNICMCKWLGMLK-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