General Information of the Compound
| Compound ID |
CP0576226
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| Compound Name |
N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-2-(5,6-dimethyl-1-benzofuran-3-yl)acetamide
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| Structure |
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| Formula |
C21H21NO4
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| Molecular Weight |
351.402
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| Canonical SMILES |
Cc1cc2occ(CC(=O)NCC3COc4ccccc4O3)c2cc1C
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| InChI |
InChI=1S/C21H21NO4/c1-13-7-17-15(11-24-20(17)8-14(13)2)9-21(23)22-10-16-12-25-18-5-3-4-6-19(18)26-16/h3-8,11,16H,9-10,12H2,1-2H3,(H,22,23)
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| InChIKey |
VRPBVUMWZASNQT-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