General Information of the Compound
| Compound ID |
CP0527610
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| Compound Name |
N-[5-[[3-[4-(5-bromopyridin-2-yl)piperazin-1-yl]-3-oxopropyl]sulfamoyl]-4-methyl-1,3-thiazol-2-yl]acetamide
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| Structure |
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| Formula |
C18H23BrN6O4S2
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| Molecular Weight |
531.458
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| Canonical SMILES |
CC(=O)Nc1nc(C)c(s1)S(=O)(=O)NCCC(=O)N1CCN(CC1)c1ccc(Br)cn1
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| InChI |
InChI=1S/C18H23BrN6O4S2/c1-12-17(30-18(22-12)23-13(2)26)31(28,29)21-6-5-16(27)25-9-7-24(8-10-25)15-4-3-14(19)11-20-15/h3-4,11,21H,5-10H2,1-2H3,(H,22,23,26)
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| InChIKey |
MDGKDGQHIUUBEB-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