General Information of the Compound
| Compound ID |
CP0418523
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| Compound Name |
5-(4-Chlorophenyl)furan-2-carboxylic acid (3-dimethylamino-2,2-dimethylpropyl)amide
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| Structure |
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| Formula |
C18H23ClN2O2
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| Molecular Weight |
334.847
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| Canonical SMILES |
CN(C)CC(C)(C)CNC(=O)c1ccc(o1)-c1ccc(Cl)cc1
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| InChI |
InChI=1S/C18H23ClN2O2/c1-18(2,12-21(3)4)11-20-17(22)16-10-9-15(23-16)13-5-7-14(19)8-6-13/h5-10H,11-12H2,1-4H3,(H,20,22)
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| InChIKey |
CNZJYNXLIROXSK-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