General Information of the Compound
| Compound ID |
CP0387828
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| Compound Name |
2-(3-Cyclohexyl-3-methylureido)-5-methylbenzoic Acid
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| Structure |
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| Formula |
C16H22N2O3
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| Molecular Weight |
290.363
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| Canonical SMILES |
CN(C1CCCCC1)C(=O)Nc1ccc(C)cc1C(O)=O
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| InChI |
InChI=1S/C16H22N2O3/c1-11-8-9-14(13(10-11)15(19)20)17-16(21)18(2)12-6-4-3-5-7-12/h8-10,12H,3-7H2,1-2H3,(H,17,21)(H,19,20)
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| InChIKey |
ZUTXOWZQOOETCR-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