General Information of the Compound
| Compound ID |
CP0430666
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| Compound Name |
N-[3-(2-ethoxy-5-methoxyphenyl)propyl]acetamide
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| Synonyms |
CHEMBL1091561
N-(3-(2-ethoxy-5-methoxyphenyl)propyl)acetamide
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| Structure |
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| Formula |
C14H21NO3
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| Molecular Weight |
251.326
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| Canonical SMILES |
CCOc1ccc(OC)cc1CCCNC(C)=O
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| InChI |
InChI=1S/C14H21NO3/c1-4-18-14-8-7-13(17-3)10-12(14)6-5-9-15-11(2)16/h7-8,10H,4-6,9H2,1-3H3,(H,15,16)
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| InChIKey |
GTXCCVOUHCBPES-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
Clinical Information about the Compound