General Information of the Compound
| Compound ID |
CP0577856
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| Compound Name |
US9266869, 9
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| Structure |
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| Formula |
C23H19FN4O3S
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| Molecular Weight |
450.495
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| Canonical SMILES |
CS(C)(=O)=NC(=O)c1cncc(c1)C#Cc1cccc(NC(=O)Nc2ccccc2F)c1
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| InChI |
InChI=1S/C23H19FN4O3S/c1-32(2,31)28-22(29)18-12-17(14-25-15-18)11-10-16-6-5-7-19(13-16)26-23(30)27-21-9-4-3-8-20(21)24/h3-9,12-15H,1-2H3,(H2,26,27,30)
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| InChIKey |
VCCYCPJAEFOQJP-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