General Information of the Compound
| Compound ID |
CP0417057
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| Compound Name |
2-(5-amino-2-propoxyphenyl)-4,5-diethyl-1H-pyrimidin-6-one
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| Structure |
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| Formula |
C17H23N3O2
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| Molecular Weight |
301.39
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| Canonical SMILES |
CCCOc1ccc(N)cc1-c1nc(CC)c(CC)c(=O)[nH]1
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| InChI |
InChI=1S/C17H23N3O2/c1-4-9-22-15-8-7-11(18)10-13(15)16-19-14(6-3)12(5-2)17(21)20-16/h7-8,10H,4-6,9,18H2,1-3H3,(H,19,20,21)
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| InChIKey |
VPTKMCYVAHHGRE-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