General Information of the Compound
| Compound ID |
CP0334669
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| Compound Name |
5-chloro-4-[(2,6-dimethyloxan-4-yl)methylamino]-2-fluoro-N-(1,3-thiazol-2-yl)benzenesulfonamide
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| Structure |
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| Formula |
C17H21ClFN3O3S2
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| Molecular Weight |
433.958
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| Canonical SMILES |
CC1CC(CNc2cc(F)c(cc2Cl)S(=O)(=O)Nc2nccs2)CC(C)O1
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| InChI |
InChI=1S/C17H21ClFN3O3S2/c1-10-5-12(6-11(2)25-10)9-21-15-8-14(19)16(7-13(15)18)27(23,24)22-17-20-3-4-26-17/h3-4,7-8,10-12,21H,5-6,9H2,1-2H3,(H,20,22)
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| InChIKey |
YJQYKCOMUJMJND-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