General Information of the Compound
| Compound ID |
CP0561469
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| Compound Name |
1-(4-chlorophenyl)-3-(2-methyl-2-phenylpropyl)urea
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| Structure |
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| Formula |
C17H19ClN2O
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| Molecular Weight |
302.805
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| Canonical SMILES |
CC(C)(CNC(=O)Nc1ccc(Cl)cc1)c1ccccc1
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| InChI |
InChI=1S/C17H19ClN2O/c1-17(2,13-6-4-3-5-7-13)12-19-16(21)20-15-10-8-14(18)9-11-15/h3-11H,12H2,1-2H3,(H2,19,20,21)
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| InChIKey |
HYLFEFRLVKVJQC-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
Protein ID: PT01298, Cannabinoid receptor 1
Protein ID: PT00834, Cannabinoid receptor 2