General Information of the Compound
| Compound ID |
CP0550152
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| Compound Name |
N-[3-(4,5-diethyl-6-oxo-1H-pyrimidin-2-yl)-4-propoxyphenyl]-2-(4-methylpiperazin-1-yl)-2-oxoacetamide
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| Structure |
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| Formula |
C24H33N5O4
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| Molecular Weight |
455.559
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| Canonical SMILES |
CCCOc1ccc(NC(=O)C(=O)N2CCN(C)CC2)cc1-c1nc(CC)c(CC)c(=O)[nH]1
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| InChI |
InChI=1S/C24H33N5O4/c1-5-14-33-20-9-8-16(25-23(31)24(32)29-12-10-28(4)11-13-29)15-18(20)21-26-19(7-3)17(6-2)22(30)27-21/h8-9,15H,5-7,10-14H2,1-4H3,(H,25,31)(H,26,27,30)
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| InChIKey |
TYQPWEPAUOWYPT-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