General Information of the Compound
| Compound ID |
CP0529154
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| Compound Name |
2-Butyl-5-chloro-3-[2'-(3,4-dimethyl-isoxazol-5-ylsulfamoyl)-biphenyl-4-ylmethyl]-3H-imidazole-4-carboxylic acid amide
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| Structure |
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| Formula |
C26H28ClN5O4S
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| Molecular Weight |
542.061
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| Canonical SMILES |
CCCCc1nc(Cl)c(C(N)=O)n1Cc1ccc(cc1)-c1ccccc1S(=O)(=O)Nc1onc(C)c1C
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| InChI |
InChI=1S/C26H28ClN5O4S/c1-4-5-10-22-29-24(27)23(25(28)33)32(22)15-18-11-13-19(14-12-18)20-8-6-7-9-21(20)37(34,35)31-26-16(2)17(3)30-36-26/h6-9,11-14,31H,4-5,10,15H2,1-3H3,(H2,28,33)
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| InChIKey |
KSOOVOZETWHNBV-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