General Information of the Compound
| Compound ID |
CP0005653
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| Compound Name |
(3-[2-(dimethylamino)ethyl]-1H-indol-5-yl)-N-methylmethanesulfonamide
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| Synonyms |
(3-[2-(Dimethylamino)ethyl]-1H-indol-5-yl)-N-methylmethanesulfonamide
1-[3-(2-dimethylaminoethyl)-1H-indol-5-yl]-N-methyl-methanesulfonamide
1-[3-(2-dimethylaminoethyl)-1H-indol-5-yl]-N-methylmethanesulfonamide
1-{3-[2-(dimethylamino)ethyl]-1H-indol-5-yl}-N-methylmethanesulfonamide
3-(2-(Dimethylamino)ethyl)-N-methyl-1H-indole-5-methanesulfonamide
3-[2-(Dimethylamino)ethyl]-N-methyl-1H-indole-5-methanesulfonamide
3-[2-(Dimethylamino)ethyl]-N-methylindole-5-methanesulfonamide
GR 43175
GR 43175X
GR-43175
Imigran (TN)
Imitrex (TN)
KS-1116
NP101
Sumatran
Sumatriptan
Sumatriptan (JAN/USP/INN)
Sumatriptanum
Sumatriptanum [INN-Latin]
Sumax
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| Structure |
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| Formula |
C14H21N3O2S
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| Molecular Weight |
295.408
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| Canonical SMILES |
CNS(=O)(=O)Cc1ccc2[nH]cc(CCN(C)C)c2c1
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| InChI |
InChI=1S/C14H21N3O2S/c1-15-20(18,19)10-11-4-5-14-13(8-11)12(9-16-14)6-7-17(2)3/h4-5,8-9,15-16H,6-7,10H2,1-3H3
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| InChIKey |
KQKPFRSPSRPDEB-UHFFFAOYSA-N
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| CAS |
103628-46-2
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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
Cell-based Assay
Protein ID: PT01202, 5-hydroxytryptamine receptor 1B
Cell-based Assay
Protein ID: PT06668, 5-hydroxytryptamine receptor 1B
Protein ID: PT00827, 5-hydroxytryptamine receptor 1D
Cell-based Assay
Protein ID: PT00957, D(2) dopamine receptor
Protein ID: PT05367, Multidrug and toxin extrusion protein 1
Protein ID: PT03795, Solute carrier family 22 member 1
Clinical Information about the Compound