General Information of the Compound
| Compound ID |
CP0563137
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| Compound Name |
US9434711, 119
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| Structure |
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| Formula |
C20H21NO2S2
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| Molecular Weight |
371.527
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| Canonical SMILES |
O=S(=O)(N(C1CCCCC1)c1cc2ccccc2s1)c1ccccc1
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| InChI |
InChI=1S/C20H21NO2S2/c22-25(23,18-12-5-2-6-13-18)21(17-10-3-1-4-11-17)20-15-16-9-7-8-14-19(16)24-20/h2,5-9,12-15,17H,1,3-4,10-11H2
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| InChIKey |
RSQTVEFSQGKSIP-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