General Information of the Compound
| Compound ID |
CP0522146
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| Compound Name |
1-(3-benzylphenyl)-3-[1-[(2-chlorophenyl)methyl]-2-oxopyridin-3-yl]urea
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| Structure |
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| Formula |
C26H22ClN3O2
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| Molecular Weight |
443.934
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| Canonical SMILES |
Clc1ccccc1Cn1cccc(NC(=O)Nc2cccc(Cc3ccccc3)c2)c1=O
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| InChI |
InChI=1S/C26H22ClN3O2/c27-23-13-5-4-11-21(23)18-30-15-7-14-24(25(30)31)29-26(32)28-22-12-6-10-20(17-22)16-19-8-2-1-3-9-19/h1-15,17H,16,18H2,(H2,28,29,32)
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| InChIKey |
HXGSBZSKQYXADT-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