General Information of the Compound
| Compound ID |
CP0161385
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| Compound Name |
1-benzyl-1-(3-(benzyloxy)benzyl)-3-isopropylurea
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| Structure |
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| Formula |
C25H28N2O2
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| Molecular Weight |
388.511
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| Canonical SMILES |
CC(C)NC(=O)N(Cc1ccccc1)Cc1cccc(OCc2ccccc2)c1
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| InChI |
InChI=1S/C25H28N2O2/c1-20(2)26-25(28)27(17-21-10-5-3-6-11-21)18-23-14-9-15-24(16-23)29-19-22-12-7-4-8-13-22/h3-16,20H,17-19H2,1-2H3,(H,26,28)
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| InChIKey |
REIGKQVKODWANW-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