General Information of the Compound
| Compound ID |
CP0535852
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| Compound Name |
5-chloro-2-fluoro-4-[[5-(4-fluorophenyl)-1,2,3,6-tetrahydropyridin-6-yl]methoxy]-N-(5-fluoropyridin-2-yl)benzenesulfonamide
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| Structure |
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| Formula |
C23H19ClF3N3O3S
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| Molecular Weight |
509.937
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| Canonical SMILES |
Fc1ccc(cc1)C1=CCCNC1COc1cc(F)c(cc1Cl)S(=O)(=O)Nc1ccc(F)cn1
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| InChI |
InChI=1S/C23H19ClF3N3O3S/c24-18-10-22(34(31,32)30-23-8-7-16(26)12-29-23)19(27)11-21(18)33-13-20-17(2-1-9-28-20)14-3-5-15(25)6-4-14/h2-8,10-12,20,28H,1,9,13H2,(H,29,30)
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| InChIKey |
UEHXSSVUQFGMKA-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