General Information of the Compound
| Compound ID |
CP0535597
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| Compound Name |
US8916553, 234
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| Structure |
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| Formula |
C18H17FN2O3S
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| Molecular Weight |
360.41
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| Canonical SMILES |
CS(=O)(=O)Nc1ccc(c(OCCF)c1)-c1cncc2ccccc12
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| InChI |
InChI=1S/C18H17FN2O3S/c1-25(22,23)21-14-6-7-16(18(10-14)24-9-8-19)17-12-20-11-13-4-2-3-5-15(13)17/h2-7,10-12,21H,8-9H2,1H3
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| InChIKey |
AXEILVVQRAEIPA-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