General Information of the Compound
| Compound ID |
CP0364847
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| Compound Name |
N-[2-(5-methoxy-2-phenyl-1-benzofuran-3-yl)ethyl]prop-2-enamide
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| Structure |
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| Formula |
C20H19NO3
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| Molecular Weight |
321.376
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| Canonical SMILES |
COc1ccc2oc(c(CCNC(=O)C=C)c2c1)-c1ccccc1
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| InChI |
InChI=1S/C20H19NO3/c1-3-19(22)21-12-11-16-17-13-15(23-2)9-10-18(17)24-20(16)14-7-5-4-6-8-14/h3-10,13H,1,11-12H2,2H3,(H,21,22)
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| InChIKey |
FVBIXCGTVBRGCA-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
Protein ID: PT01843, Melatonin receptor type 1A
Protein ID: PT02174, Melatonin receptor type 1B