General Information of the Compound
| Compound ID |
CP0397757
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| Compound Name |
5-methyl-3-[[4-(3-piperidin-1-ylpropoxy)phenyl]methyl]-1H-pyrimidine-2,4-dione
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| Structure |
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| Formula |
C20H27N3O3
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| Molecular Weight |
357.454
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| Canonical SMILES |
Cc1c[nH]c(=O)n(Cc2ccc(OCCCN3CCCCC3)cc2)c1=O
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| InChI |
InChI=1S/C20H27N3O3/c1-16-14-21-20(25)23(19(16)24)15-17-6-8-18(9-7-17)26-13-5-12-22-10-3-2-4-11-22/h6-9,14H,2-5,10-13,15H2,1H3,(H,21,25)
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| InChIKey |
QEABETJOTHLUAO-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