General Information of the Compound
| Compound ID |
CP0532635
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| Compound Name |
US9434711, 754
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| Structure |
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| Formula |
C28H24F3NO5S2
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| Molecular Weight |
575.63
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| Canonical SMILES |
COC(=O)c1ccc(cc1)S(=O)(=O)N(Cc1ccc(OC(F)(F)F)cc1)c1sc2ccccc2c1C1CCC1
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| InChI |
InChI=1S/C28H24F3NO5S2/c1-36-27(33)20-11-15-22(16-12-20)39(34,35)32(17-18-9-13-21(14-10-18)37-28(29,30)31)26-25(19-5-4-6-19)23-7-2-3-8-24(23)38-26/h2-3,7-16,19H,4-6,17H2,1H3
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| InChIKey |
IVBCMSNTKQSNJR-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