General Information of the Compound
| Compound ID |
CP0474501
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| Compound Name |
US9192603, 21
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| Structure |
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| Formula |
C17H13F2N3O4S2
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| Molecular Weight |
425.438
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| Canonical SMILES |
OCc1nc(NC(=O)c2ccccn2)sc1S(=O)(=O)Cc1c(F)cccc1F
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| InChI |
InChI=1S/C17H13F2N3O4S2/c18-11-4-3-5-12(19)10(11)9-28(25,26)16-14(8-23)21-17(27-16)22-15(24)13-6-1-2-7-20-13/h1-7,23H,8-9H2,(H,21,22,24)
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| InChIKey |
DHODPMXQCWQCCQ-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