General Information of the Compound
| Compound ID |
CP0567089
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| Compound Name |
5-chloro-2-fluoro-4-[[5-(3-methoxyphenyl)-1,2,3,6-tetrahydropyridin-6-yl]methoxy]-N-(1,3-thiazol-4-yl)benzenesulfonamide
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| Structure |
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| Formula |
C22H21ClFN3O4S2
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| Molecular Weight |
510.012
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| Canonical SMILES |
COc1cccc(c1)C1=CCCNC1COc1cc(F)c(cc1Cl)S(=O)(=O)Nc1cscn1
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| InChI |
InChI=1S/C22H21ClFN3O4S2/c1-30-15-5-2-4-14(8-15)16-6-3-7-25-19(16)11-31-20-10-18(24)21(9-17(20)23)33(28,29)27-22-12-32-13-26-22/h2,4-6,8-10,12-13,19,25,27H,3,7,11H2,1H3
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| InChIKey |
IXHMRIYGEUPHCA-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