saprisartan   Click here for help

GtoPdb Ligand ID: 6899

Synonyms: GR 138950 | GR-138950 | GR138950
Compound class: Synthetic organic
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2D Structure
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Physico-chemical Properties
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Hydrogen bond acceptors 6
Hydrogen bond donors 2
Rotatable bonds 9
Topological polar surface area 128.6
Molecular weight 610.05
XLogP 5.11
No. Lipinski's rules broken 1
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Canonical SMILES CCc1nc(c(n1Cc1ccc2c(c1)c(Br)c(o2)c1ccccc1NS(=O)(=O)C(F)(F)F)C(=O)N)C1CC1
Isomeric SMILES CCc1nc(c(n1Cc1ccc2c(c1)c(Br)c(o2)c1ccccc1NS(=O)(=O)C(F)(F)F)C(=O)N)C1CC1
InChI InChI=1S/C25H22BrF3N4O4S/c1-2-19-31-21(14-8-9-14)22(24(30)34)33(19)12-13-7-10-18-16(11-13)20(26)23(37-18)15-5-3-4-6-17(15)32-38(35,36)25(27,28)29/h3-7,10-11,14,32H,2,8-9,12H2,1H3,(H2,30,34)
Classification Click here for help
Compound class Synthetic organic
IUPAC Name Click here for help
International Nonproprietary Names Click here for help
INN number INN
7306 saprisartan
Synonyms Click here for help
GR 138950 | GR-138950 | GR138950
Database Links Click here for help
Specialist databases
GPCRdb Ligand saprisartan
Other databases
CAS Registry No. 146623-69-0 (source: Scifinder)
ChEMBL Ligand CHEMBL305544
DrugBank Ligand DB01347
GtoPdb PubChem SID 178103481
PubChem CID 60921
Search Google for chemical match using the InChIKey DUEWVPTZCSAMNB-UHFFFAOYSA-N
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UniChem Compound Search for chemical match using the InChIKey DUEWVPTZCSAMNB-UHFFFAOYSA-N
UniChem Connectivity Search for chemical match using the InChIKey DUEWVPTZCSAMNB-UHFFFAOYSA-N