General Information of the Compound
| Compound ID |
CP0534933
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| Compound Name |
1-(4-chlorophenyl)-3-[2-(2,4,6-trifluorophenyl)ethyl]urea
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| Structure |
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| Formula |
C15H12ClF3N2O
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| Molecular Weight |
328.721
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| Canonical SMILES |
Fc1cc(F)c(CCNC(=O)Nc2ccc(Cl)cc2)c(F)c1
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| InChI |
InChI=1S/C15H12ClF3N2O/c16-9-1-3-11(4-2-9)21-15(22)20-6-5-12-13(18)7-10(17)8-14(12)19/h1-4,7-8H,5-6H2,(H2,20,21,22)
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| InChIKey |
WWGUHTUUEIFLFJ-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