General Information of the Compound
| Compound ID |
CP0960097
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| Compound Name |
2-Chlorobenzyl 6-methyl-2-oxo-4-phenyl-1,2,3,4-tetrahydropyrimidine-5-carboxylate
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| Structure |
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| Formula |
C19H17ClN2O3
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| Molecular Weight |
356.809
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| Canonical SMILES |
CC1=C(C(=O)OCc2ccccc2Cl)C(c2ccccc2)NC(=O)N1
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| InChI |
InChI=1S/C19H17ClN2O3/c1-12-16(18(23)25-11-14-9-5-6-10-15(14)20)17(22-19(24)21-12)13-7-3-2-4-8-13/h2-10,17H,11H2,1H3,(H2,21,22,24)
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| InChIKey |
ZDLMUHWUCWIIMU-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