General Information of the Compound
| Compound ID |
CP0000082
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| Compound Name |
CAS_68647
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| Synonyms |
(RS)-1,2,3,9-Tetrahydro-9-methyl-3-(2-methylimidazol-1-ylmethyl)carbazol-4-one
1,2,3,9-Tetrahydro-9-methyl-3-((2-methyl-1H-imidazol-1-yl)methyl)-4H-carbazol-4-one
9-Methyl-3-(2-methyl-imidazol-1-ylmethyl)-1,2,3,9-tetrahydro-carbazol-4-one
9-methyl-3-[(2-methyl-1H-imidazol-1-yl)methyl]-1,2,3,9-tetrahydro-4H-carbazol-4-one
9-methyl-3-[(2-methylimidazol-1-yl)methyl]-2,3-dihydro-1H-carbazol-4-one
Apo-ondansetron
DESMETHYLONDANSETRON
GR 38032
GR 38032X
GR-38032F
GR38032F
Novo-ondansetron
Ondansetron
Ondansetron (JAN/USP/INN)
Ondansetron (Zofran)
Ondansetron [USAN:INN:BAN]
Ondansetron, (+,-)-Isomer
PHL-ondansetron
PMS-ondansetron
Ratio-ondansetron
SN-307
Sandoz ondansetron
ZOFRAN IN PLASTIC CONTAINER
Zofran
Zofran (TN)
Zofran ODT
Zofran ODT (TN)
Zophren
Zudan
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| Structure |
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| Formula |
C18H19N3O
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| Molecular Weight |
293.37
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| Canonical SMILES |
Cc1nccn1CC1CCc2c(C1=O)c1ccccc1n2C
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| InChI |
InChI=1S/C18H19N3O/c1-12-19-9-10-21(12)11-13-7-8-16-17(18(13)22)14-5-3-4-6-15(14)20(16)2/h3-6,9-10,13H,7-8,11H2,1-2H3
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| InChIKey |
FELGMEQIXOGIFQ-UHFFFAOYSA-N
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| CAS |
99614-02-5
108303-49-7
116002-70-1
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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: PT02227, 5-hydroxytryptamine receptor 3A
Protein ID: PT00941, 5-hydroxytryptamine receptor 7
Protein ID: PT01005, D(2) dopamine receptor
Protein ID: PT05367, Multidrug and toxin extrusion protein 1
Cell-based Assay
Protein ID: PT05330, Multidrug and toxin extrusion protein 2
Protein ID: PT00897, Potassium voltage-gated channel subfamily H member 2
Protein ID: PT03795, Solute carrier family 22 member 1
Protein ID: PT04591, Solute carrier family 22 member 2
Protein ID: PT06607, Solute carrier family 22 member 3
Clinical Information about the Compound