General Information of the Compound
| Compound ID |
CP0219108
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| Compound Name |
N-[2-(4-tert-butylanilino)-1-(4-methoxyphenyl)-2-oxoethyl]-6-oxo-1H-pyridine-3-carboxamide
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| Structure |
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| Formula |
C25H27N3O4
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| Molecular Weight |
433.508
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| Canonical SMILES |
COc1ccc(cc1)C(NC(=O)c1ccc(=O)[nH]c1)C(=O)Nc1ccc(cc1)C(C)(C)C
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| InChI |
InChI=1S/C25H27N3O4/c1-25(2,3)18-8-10-19(11-9-18)27-24(31)22(16-5-12-20(32-4)13-6-16)28-23(30)17-7-14-21(29)26-15-17/h5-15,22H,1-4H3,(H,26,29)(H,27,31)(H,28,30)
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| InChIKey |
UKBDCMASILOVDE-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