General Information of the Compound
| Compound ID |
CP0534080
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| Compound Name |
N-[2-(2-ethoxy-6-methoxybenzimidazol-1-yl)ethyl]acetamide
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| Structure |
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| Formula |
C14H19N3O3
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| Molecular Weight |
277.324
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| Canonical SMILES |
CCOc1nc2ccc(OC)cc2n1CCNC(C)=O
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| InChI |
InChI=1S/C14H19N3O3/c1-4-20-14-16-12-6-5-11(19-3)9-13(12)17(14)8-7-15-10(2)18/h5-6,9H,4,7-8H2,1-3H3,(H,15,18)
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| InChIKey |
MRWHUOOPUIAFSB-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