General Information of the Compound
| Compound ID |
CP0565749
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| Compound Name |
US9434711, 523
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| Structure |
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| Formula |
C24H19NO6S2
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| Molecular Weight |
481.551
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| Canonical SMILES |
Cc1c(sc2ccccc12)N(Cc1ccc2OCOc2c1)S(=O)(=O)c1ccc(cc1)C(O)=O
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| InChI |
InChI=1S/C24H19NO6S2/c1-15-19-4-2-3-5-22(19)32-23(15)25(13-16-6-11-20-21(12-16)31-14-30-20)33(28,29)18-9-7-17(8-10-18)24(26)27/h2-12H,13-14H2,1H3,(H,26,27)
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| InChIKey |
VHQBASBYNIWZMK-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