General Information of the Compound
| Compound ID |
CP0563208
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| Compound Name |
US9169240, 5
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| Structure |
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| Formula |
C17H12N4O4S2
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| Molecular Weight |
400.441
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| Canonical SMILES |
NS(=O)(=O)Cc1nnc(o1)C(=O)c1nc2ccc(cc2s1)-c1ccccc1
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| InChI |
InChI=1S/C17H12N4O4S2/c18-27(23,24)9-14-20-21-16(25-14)15(22)17-19-12-7-6-11(8-13(12)26-17)10-4-2-1-3-5-10/h1-8H,9H2,(H2,18,23,24)
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| InChIKey |
UWVLJDRMKTYYTK-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