General Information of the Compound
| Compound ID |
CP0439703
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| Compound Name |
N-[(4-tert-butylphenyl)methyl]-2-(3-chloro-4-hydroxyphenyl)acetamide
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| Structure |
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| Formula |
C19H22ClNO2
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| Molecular Weight |
331.843
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| Canonical SMILES |
CC(C)(C)c1ccc(CNC(=O)Cc2ccc(O)c(Cl)c2)cc1
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| InChI |
InChI=1S/C19H22ClNO2/c1-19(2,3)15-7-4-13(5-8-15)12-21-18(23)11-14-6-9-17(22)16(20)10-14/h4-10,22H,11-12H2,1-3H3,(H,21,23)
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| InChIKey |
ZFDDNRZRPJIICS-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