General Information of the Compound
| Compound ID |
CP0844959
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| Compound Name |
N-[2-(2-{[Ethyl(methyl)amino]methyl}-5-methoxy-1H-indol-3-yl)ethyl]acetamide
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| Structure |
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| Formula |
C17H25N3O2
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| Molecular Weight |
303.406
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| Canonical SMILES |
CCN(C)Cc1[nH]c2ccc(OC)cc2c1CCNC(C)=O
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| InChI |
InChI=1S/C17H25N3O2/c1-5-20(3)11-17-14(8-9-18-12(2)21)15-10-13(22-4)6-7-16(15)19-17/h6-7,10,19H,5,8-9,11H2,1-4H3,(H,18,21)
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| InChIKey |
JUDFDBKKMBAQSU-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