General Information of the Compound
| Compound ID |
CP0450091
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| Compound Name |
US8916553, 233
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| Structure |
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| Formula |
C15H15F3N2O4S
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| Molecular Weight |
376.356
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| Canonical SMILES |
COc1ccncc1-c1ccc(NS(C)(=O)=O)cc1OCC(F)(F)F
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| InChI |
InChI=1S/C15H15F3N2O4S/c1-23-13-5-6-19-8-12(13)11-4-3-10(20-25(2,21)22)7-14(11)24-9-15(16,17)18/h3-8,20H,9H2,1-2H3
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| InChIKey |
YQOLWWLBOKYDQE-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