General Information of the Compound
| Compound ID |
CP0124889
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| Compound Name |
N-[2-(4-tert-butyl-3-chloroanilino)-1-(4-methoxyphenyl)-2-oxoethyl]-N-methyl-6-oxo-1H-pyridine-3-carboxamide
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| Structure |
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| Formula |
C26H28ClN3O4
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| Molecular Weight |
481.98
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| Canonical SMILES |
COc1ccc(cc1)C(N(C)C(=O)c1ccc(=O)[nH]c1)C(=O)Nc1ccc(c(Cl)c1)C(C)(C)C
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| InChI |
InChI=1S/C26H28ClN3O4/c1-26(2,3)20-12-9-18(14-21(20)27)29-24(32)23(16-6-10-19(34-5)11-7-16)30(4)25(33)17-8-13-22(31)28-15-17/h6-15,23H,1-5H3,(H,28,31)(H,29,32)
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| InChIKey |
WRHOROHKVPGYIS-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