General Information of the Compound
| Compound ID |
CP0520608
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| Compound Name |
US9192603, 23
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| Structure |
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| Formula |
C17H12F3N3O3S2
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| Molecular Weight |
427.429
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| Canonical SMILES |
FCc1nc(NC(=O)c2ccccn2)sc1S(=O)(=O)Cc1c(F)cccc1F
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| InChI |
InChI=1S/C17H12F3N3O3S2/c18-8-14-16(28(25,26)9-10-11(19)4-3-5-12(10)20)27-17(22-14)23-15(24)13-6-1-2-7-21-13/h1-7H,8-9H2,(H,22,23,24)
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| InChIKey |
BDMKFPIDFLVMAZ-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