General Information of the Compound
| Compound ID |
CP0460214
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| Compound Name |
N-[2-(5-methoxy-1,7-dimethylindol-3-yl)ethyl]acetamide
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| Structure |
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| Formula |
C15H20N2O2
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| Molecular Weight |
260.337
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| Canonical SMILES |
COc1cc(C)c2n(C)cc(CCNC(C)=O)c2c1
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| InChI |
InChI=1S/C15H20N2O2/c1-10-7-13(19-4)8-14-12(5-6-16-11(2)18)9-17(3)15(10)14/h7-9H,5-6H2,1-4H3,(H,16,18)
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| InChIKey |
QUPBATMCRZDEBU-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