General Information of the Compound
| Compound ID |
CP0402870
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| Compound Name |
4-[2-[(3-methoxyphenyl)methyl]-4-methyl-1,3-thiazol-5-yl]-2-methylbenzamide
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| Structure |
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| Formula |
C20H20N2O2S
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| Molecular Weight |
352.459
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| Canonical SMILES |
COc1cccc(Cc2nc(C)c(s2)-c2ccc(C(N)=O)c(C)c2)c1
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| InChI |
InChI=1S/C20H20N2O2S/c1-12-9-15(7-8-17(12)20(21)23)19-13(2)22-18(25-19)11-14-5-4-6-16(10-14)24-3/h4-10H,11H2,1-3H3,(H2,21,23)
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| InChIKey |
HSNLLRHJMVGRMB-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