General Information of the Compound
| Compound ID |
CP0492933
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| Compound Name |
US9434711, 567
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| Structure |
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| Formula |
C23H25NO4S2
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| Molecular Weight |
443.59
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| Canonical SMILES |
CC(C)c1c(sc2ccccc12)N(CCC1CC1)S(=O)(=O)c1ccc(cc1)C(O)=O
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| InChI |
InChI=1S/C23H25NO4S2/c1-15(2)21-19-5-3-4-6-20(19)29-22(21)24(14-13-16-7-8-16)30(27,28)18-11-9-17(10-12-18)23(25)26/h3-6,9-12,15-16H,7-8,13-14H2,1-2H3,(H,25,26)
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| InChIKey |
WSEOWLBLZGARFY-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