General Information of the Compound
| Compound ID |
CP0564978
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| Compound Name |
N-[2-(4-tert-butylanilino)-1-(4-methoxyphenyl)-2-oxoethyl]-N-methyl-1,2-oxazole-5-carboxamide
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| Structure |
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| Formula |
C24H27N3O4
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| Molecular Weight |
421.497
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| Canonical SMILES |
COc1ccc(cc1)C(N(C)C(=O)c1ccno1)C(=O)Nc1ccc(cc1)C(C)(C)C
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| InChI |
InChI=1S/C24H27N3O4/c1-24(2,3)17-8-10-18(11-9-17)26-22(28)21(16-6-12-19(30-5)13-7-16)27(4)23(29)20-14-15-25-31-20/h6-15,21H,1-5H3,(H,26,28)
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| InChIKey |
JVHYBXVQYDVUSC-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