General Information of the Compound
| Compound ID |
CP0559604
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| Compound Name |
4-tert-butyl-N-[4-[2-[di(propan-2-yl)amino]ethoxy]-3-methoxyphenyl]benzamide
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| Structure |
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| Formula |
C26H38N2O3
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| Molecular Weight |
426.601
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| Canonical SMILES |
COc1cc(NC(=O)c2ccc(cc2)C(C)(C)C)ccc1OCCN(C(C)C)C(C)C
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| InChI |
InChI=1S/C26H38N2O3/c1-18(2)28(19(3)4)15-16-31-23-14-13-22(17-24(23)30-8)27-25(29)20-9-11-21(12-10-20)26(5,6)7/h9-14,17-19H,15-16H2,1-8H3,(H,27,29)
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| InChIKey |
STWLTSSRVSGYBW-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