General Information of the Compound
| Compound ID |
CP0435969
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| Compound Name |
5-[5-methyl-4-(3-piperidin-1-ylpropoxy)-1,3-thiazol-2-yl]-3H-2-benzofuran-1-one
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| Structure |
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| Formula |
C20H24N2O3S
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| Molecular Weight |
372.49
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| Canonical SMILES |
Cc1sc(nc1OCCCN1CCCCC1)-c1ccc2C(=O)OCc2c1
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| InChI |
InChI=1S/C20H24N2O3S/c1-14-18(24-11-5-10-22-8-3-2-4-9-22)21-19(26-14)15-6-7-17-16(12-15)13-25-20(17)23/h6-7,12H,2-5,8-11,13H2,1H3
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| InChIKey |
ROAVUXKHIGGGCW-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