General Information of the Compound
| Compound ID |
CP0259082
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| Compound Name |
N-[2-[(4-butoxy-2,5-dimethylphenyl)methylamino]-1-phenylethyl]-5-methyl-1,2-oxazole-3-carboxamide
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| Structure |
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| Formula |
C26H33N3O3
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| Molecular Weight |
435.568
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| Canonical SMILES |
CCCCOc1cc(C)c(CNCC(NC(=O)c2cc(C)on2)c2ccccc2)cc1C
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| InChI |
InChI=1S/C26H33N3O3/c1-5-6-12-31-25-14-18(2)22(13-19(25)3)16-27-17-24(21-10-8-7-9-11-21)28-26(30)23-15-20(4)32-29-23/h7-11,13-15,24,27H,5-6,12,16-17H2,1-4H3,(H,28,30)
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| InChIKey |
UCUNHQRXMTUEQY-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