General Information of the Compound
| Compound ID |
CP0537386
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| Compound Name |
US9434711, 460
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| Structure |
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| Formula |
C24H17F4NO5S2
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| Molecular Weight |
539.528
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| Canonical SMILES |
CC(=O)C1=C(N(Cc2ccc(F)c(c2)C(F)(F)F)S(=O)(=O)c2ccccc2)S(=O)(=O)c2ccccc12
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| InChI |
InChI=1S/C24H17F4NO5S2/c1-15(30)22-18-9-5-6-10-21(18)35(31,32)23(22)29(36(33,34)17-7-3-2-4-8-17)14-16-11-12-20(25)19(13-16)24(26,27)28/h2-13H,14H2,1H3
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| InChIKey |
ZUTFKAJULRFBKO-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