General Information of the Compound
| Compound ID |
CP0951948
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| Compound Name |
4-Methoxybenzyl 2-oxo-6-(benzamidomethyl)-4-phenyl-1,2,3,4-tetrahydropyrimidine-5-carboxylate
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| Structure |
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| Formula |
C27H25N3O5
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| Molecular Weight |
471.513
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| Canonical SMILES |
COc1ccc(COC(=O)C2=C(CNC(=O)c3ccccc3)NC(=O)NC2c2ccccc2)cc1
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| InChI |
InChI=1S/C27H25N3O5/c1-34-21-14-12-18(13-15-21)17-35-26(32)23-22(16-28-25(31)20-10-6-3-7-11-20)29-27(33)30-24(23)19-8-4-2-5-9-19/h2-15,24H,16-17H2,1H3,(H,28,31)(H2,29,30,33)
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| InChIKey |
YGFNDLJLKIQSOO-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