General Information of the Compound
| Compound ID |
CP0543479
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| Compound Name |
1-[1-[(2-chlorophenyl)methyl]-2-oxopyridin-3-yl]-3-(2-ethylphenyl)urea
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| Structure |
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| Formula |
C21H20ClN3O2
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| Molecular Weight |
381.863
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| Canonical SMILES |
CCc1ccccc1NC(=O)Nc1cccn(Cc2ccccc2Cl)c1=O
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| InChI |
InChI=1S/C21H20ClN3O2/c1-2-15-8-4-6-11-18(15)23-21(27)24-19-12-7-13-25(20(19)26)14-16-9-3-5-10-17(16)22/h3-13H,2,14H2,1H3,(H2,23,24,27)
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| InChIKey |
YTEISNROOAVZQK-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