General Information of the Compound
| Compound ID |
CP0555173
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| Compound Name |
US9067935, 66
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| Structure |
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| Formula |
C19H17F6N3O2S
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| Molecular Weight |
465.419
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| Canonical SMILES |
CCc1c(nc2c(cccn12)C(F)(F)F)N(CCC(F)(F)F)S(=O)(=O)c1ccccc1
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| InChI |
InChI=1S/C19H17F6N3O2S/c1-2-15-17(26-16-14(19(23,24)25)9-6-11-27(15)16)28(12-10-18(20,21)22)31(29,30)13-7-4-3-5-8-13/h3-9,11H,2,10,12H2,1H3
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| InChIKey |
YNZKHSORUKRXAW-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