General Information of the Compound
| Compound ID |
CP0189183
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| Compound Name |
N-[2-(4-tert-butylanilino)-1-(4-methoxyphenyl)-2-oxoethyl]-6-oxo-N-propyl-1H-pyridine-3-carboxamide
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| Structure |
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| Formula |
C28H33N3O4
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| Molecular Weight |
475.589
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| Canonical SMILES |
CCCN(C(C(=O)Nc1ccc(cc1)C(C)(C)C)c1ccc(OC)cc1)C(=O)c1ccc(=O)[nH]c1
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| InChI |
InChI=1S/C28H33N3O4/c1-6-17-31(27(34)20-9-16-24(32)29-18-20)25(19-7-14-23(35-5)15-8-19)26(33)30-22-12-10-21(11-13-22)28(2,3)4/h7-16,18,25H,6,17H2,1-5H3,(H,29,32)(H,30,33)
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| InChIKey |
GBZISXYXYVOTCC-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