General Information of the Compound
| Compound ID |
CP0419259
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| Compound Name |
US9434711, 688
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| Structure |
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| Formula |
C20H22N2O2S2
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| Molecular Weight |
386.542
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| Canonical SMILES |
CNc1ccc(cc1)S(=O)(=O)N(CCC1CC1)c1cc2ccccc2s1
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| InChI |
InChI=1S/C20H22N2O2S2/c1-21-17-8-10-18(11-9-17)26(23,24)22(13-12-15-6-7-15)20-14-16-4-2-3-5-19(16)25-20/h2-5,8-11,14-15,21H,6-7,12-13H2,1H3
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| InChIKey |
VPBMHZOJPUGDOE-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