General Information of the Compound
| Compound ID |
CP0471767
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| Compound Name |
US9884843, Compound 6
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| Structure |
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| Formula |
C14H9BrClFO4S
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| Molecular Weight |
407.644
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| Canonical SMILES |
OC1CS(=O)(=O)c2ccc(Oc3cc(F)cc(Cl)c3)c(Br)c12
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| InChI |
InChI=1S/C14H9BrClFO4S/c15-14-11(21-9-4-7(16)3-8(17)5-9)1-2-12-13(14)10(18)6-22(12,19)20/h1-5,10,18H,6H2
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| InChIKey |
DXJVGIAJQSXAAS-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