General Information of the Compound
| Compound ID |
CP0419171
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| Compound Name |
US9320734, 450
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| Structure |
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| Formula |
C14H16N4O5S
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| Molecular Weight |
352.372
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| Canonical SMILES |
COc1cc(NS(=O)(=O)c2ccc(NC(C)=O)cc2)nc(OC)n1
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| InChI |
InChI=1S/C14H16N4O5S/c1-9(19)15-10-4-6-11(7-5-10)24(20,21)18-12-8-13(22-2)17-14(16-12)23-3/h4-8H,1-3H3,(H,15,19)(H,16,17,18)
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| InChIKey |
WIYOSEJTAADVPJ-UHFFFAOYSA-N
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| CAS |
555-25-9
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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