General Information of the Compound
| Compound ID |
CP0486448
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| Compound Name |
2-[4-[(4-tert-butylbenzoyl)amino]-2-methoxyphenyl]acetic acid
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| Structure |
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| Formula |
C20H23NO4
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| Molecular Weight |
341.407
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| Canonical SMILES |
COc1cc(NC(=O)c2ccc(cc2)C(C)(C)C)ccc1CC(O)=O
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| InChI |
InChI=1S/C20H23NO4/c1-20(2,3)15-8-5-13(6-9-15)19(24)21-16-10-7-14(11-18(22)23)17(12-16)25-4/h5-10,12H,11H2,1-4H3,(H,21,24)(H,22,23)
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| InChIKey |
DZFXDVQWOXZOEB-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