General Information of the Compound
| Compound ID |
CP0634458
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| Compound Name |
5-(Cyclohexanecarbonyl-amino)-4'-methyl-biphenyl-3-carboxylic acid(2-methoxy-1-methyl-ethyl)-amide
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| Structure |
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| Formula |
C25H32N2O3
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| Molecular Weight |
408.542
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| Canonical SMILES |
COCC(C)NC(=O)c1cc(NC(=O)C2CCCCC2)cc(-c2ccc(C)cc2)c1
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| InChI |
InChI=1S/C25H32N2O3/c1-17-9-11-19(12-10-17)21-13-22(25(29)26-18(2)16-30-3)15-23(14-21)27-24(28)20-7-5-4-6-8-20/h9-15,18,20H,4-8,16H2,1-3H3,(H,26,29)(H,27,28)
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| InChIKey |
VMNIHWGWCFAMOQ-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