General Information of the Compound
| Compound ID |
CP0506407
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| Compound Name |
2,3,4,5,6-pentafluoro-N-[4-hydroxy-3-(1H-1,2,4-triazol-5-ylsulfanyl)naphthalen-1-yl]benzenesulfonamide
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| Structure |
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| Formula |
C18H9F5N4O3S2
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| Molecular Weight |
488.419
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| Canonical SMILES |
Oc1c(Sc2nnc[nH]2)cc(NS(=O)(=O)c2c(F)c(F)c(F)c(F)c2F)c2ccccc12
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| InChI |
InChI=1S/C18H9F5N4O3S2/c19-11-12(20)14(22)17(15(23)13(11)21)32(29,30)27-9-5-10(31-18-24-6-25-26-18)16(28)8-4-2-1-3-7(8)9/h1-6,27-28H,(H,24,25,26)
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| InChIKey |
XUZIRLCQDOZFAE-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