General Information of the Compound
| Compound ID |
CP0535536
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| Compound Name |
US9278960, 3-35
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| Structure |
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| Formula |
C24H17FN4O4S
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| Molecular Weight |
476.489
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| Canonical SMILES |
NC(=O)c1cc(-c2ccc(F)cc2)c2ccc(Cn3c(nc4ccccc34)S(O)(=O)=O)cc2n1
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| InChI |
InChI=1S/C24H17FN4O4S/c25-16-8-6-15(7-9-16)18-12-21(23(26)30)27-20-11-14(5-10-17(18)20)13-29-22-4-2-1-3-19(22)28-24(29)34(31,32)33/h1-12H,13H2,(H2,26,30)(H,31,32,33)
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| InChIKey |
KNNFYCYEMOKVHQ-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