General Information of the Compound
| Compound ID |
CP0951951
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| Compound Name |
2-Methylbenzyl 6-methyl-2-oxo-4-phenyl-1,2,3,4-tetrahydropyrimidine-5-carboxylate
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| Structure |
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| Formula |
C20H20N2O3
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| Molecular Weight |
336.391
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| Canonical SMILES |
CC1=C(C(=O)OCc2ccccc2C)C(c2ccccc2)NC(=O)N1
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| InChI |
InChI=1S/C20H20N2O3/c1-13-8-6-7-11-16(13)12-25-19(23)17-14(2)21-20(24)22-18(17)15-9-4-3-5-10-15/h3-11,18H,12H2,1-2H3,(H2,21,22,24)
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| InChIKey |
WEHMWNUQBWOFMS-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