General Information of the Compound
| Compound ID |
CP0099665
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| Compound Name |
2-(5-Methoxy-1H-indol-3-yl)-1-methyl-ethylamine
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| Synonyms |
2-(5-Methoxy-1H-indol-3-yl)-1-methyl-ethylamine
5-methoxy-alpha-methyltryptamine
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| Structure |
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| Formula |
C12H16N2O
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| Molecular Weight |
204.273
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| Canonical SMILES |
COc1ccc2[nH]cc(CC(C)N)c2c1
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| InChI |
InChI=1S/C12H16N2O/c1-8(13)5-9-7-14-12-4-3-10(15-2)6-11(9)12/h3-4,6-8,14H,5,13H2,1-2H3
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| InChIKey |
OGNJZVNNKBZFRM-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: PT00819, 5-hydroxytryptamine receptor 1A
Protein ID: PT00825, 5-hydroxytryptamine receptor 2A
Protein ID: PT01019, 5-hydroxytryptamine receptor 2B
Protein ID: PT01480, 5-hydroxytryptamine receptor 2C
Protein ID: PT00939, 5-hydroxytryptamine receptor 2C
Clinical Information about the Compound