General Information of the Compound
| Compound ID |
CP0404025
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| Compound Name |
1-[[1-(1,3-benzodioxol-5-yl)-2-(6-methylpyridin-2-yl)imidazol-4-yl]methyl]-3-phenylurea
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| Structure |
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| Formula |
C24H21N5O3
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| Molecular Weight |
427.464
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| Canonical SMILES |
Cc1cccc(n1)-c1nc(CNC(=O)Nc2ccccc2)cn1-c1ccc2OCOc2c1
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| InChI |
InChI=1S/C24H21N5O3/c1-16-6-5-9-20(26-16)23-27-18(13-25-24(30)28-17-7-3-2-4-8-17)14-29(23)19-10-11-21-22(12-19)32-15-31-21/h2-12,14H,13,15H2,1H3,(H2,25,28,30)
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| InChIKey |
IVOFRIQQPQFOFO-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