General Information of the Compound
| Compound ID |
CP0453266
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| Compound Name |
(E)-3-(4-tert-Butyl-phenyl)-N-(4-methoxy-phenyl)-acrylamide
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| Structure |
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| Formula |
C20H23NO2
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| Molecular Weight |
309.409
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| Canonical SMILES |
COc1ccc(NC(=O)\C=C\c2ccc(cc2)C(C)(C)C)cc1
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| InChI |
InChI=1S/C20H23NO2/c1-20(2,3)16-8-5-15(6-9-16)7-14-19(22)21-17-10-12-18(23-4)13-11-17/h5-14H,1-4H3,(H,21,22)/b14-7+
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| InChIKey |
KRLOIZLELVZKIX-VGOFMYFVSA-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