rizatriptan   Click here for help

GtoPdb Ligand ID: 51

Synonyms: Maxalt® | MK-0462 | MK-462 | MK-A462 | rizatriptan benzoate
Approved drug
rizatriptan is an approved drug (FDA (1998))
Compound class: Synthetic organic
Comment: Rizatriptan is a triptan 5-HT1 receptor agonist anti-migraine drug.
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2D Structure
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Physico-chemical Properties
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Hydrogen bond acceptors 3
Hydrogen bond donors 1
Rotatable bonds 5
Topological polar surface area 49.74
Molecular weight 269.16
XLogP 1.47
No. Lipinski's rules broken 0
SMILES / InChI / InChIKey
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Canonical SMILES CN(CCc1c[nH]c2c1cc(cc2)Cn1cncn1)C
Isomeric SMILES CN(CCc1c[nH]c2c1cc(cc2)Cn1cncn1)C
InChI InChI=1S/C15H19N5/c1-19(2)6-5-13-8-17-15-4-3-12(7-14(13)15)9-20-11-16-10-18-20/h3-4,7-8,10-11,17H,5-6,9H2,1-2H3
InChI Key ULFRLSNUDGIQQP-UHFFFAOYSA-N
Classification Click here for help
Compound class Synthetic organic
Approved drug? Yes (FDA (1998))
IUPAC Name Click here for help
N,N-dimethyl-2-[5-(1,2,4-triazol-1-ylmethyl)-1H-indol-3-yl]ethanamine
International Nonproprietary Names Click here for help
INN number INN
7474 rizatriptan
Synonyms Click here for help
Maxalt® | MK-0462 | MK-462 | MK-A462 | rizatriptan benzoate
Database Links Click here for help
BindingDB Ligand 50033437
CAS Registry No. 144034-80-0 (source: ChEBI)
ChEBI CHEBI:48273
ChEMBL Ligand CHEMBL905
DrugBank Ligand DB00953
DrugCentral Ligand 2393
GtoPdb PubChem SID 135650905
PubChem CID 5078
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Wikipedia Rizatriptan