General Information of the Compound
| Compound ID |
CP0531490
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| Compound Name |
US9434711, 413
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| Structure |
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| Formula |
C23H16F4N2O3S2
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| Molecular Weight |
508.518
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| Canonical SMILES |
NC(=O)c1ccc(cc1)S(=O)(=O)N(Cc1ccc(F)c(c1)C(F)(F)F)c1cc2ccccc2s1
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| InChI |
InChI=1S/C23H16F4N2O3S2/c24-19-10-5-14(11-18(19)23(25,26)27)13-29(21-12-16-3-1-2-4-20(16)33-21)34(31,32)17-8-6-15(7-9-17)22(28)30/h1-12H,13H2,(H2,28,30)
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| InChIKey |
ZRYBBSAMRHBMMR-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