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Ligand

NameCHEMBL364418
Molecular formulaC25H25FN6S
IUPAC name4-[3-(6-fluoroquinolin-2-yl)-5-[2-(1H-indol-3-yl)ethylsulfanyl]-1,2,4-triazol-4-yl]butan-1-amine
Molecular weight460.575
Hydrogen bond acceptor6
Hydrogen bond donor2
XlogP4.1
Synonyms4-{3-(6-Fluoro-quinolin-2-yl)-5-[2-(1H-indol-3-yl)-ethylsulfanyl]-[1,2,4]triazol-4-yl}-butylamine
BDBM50169469
Inchi KeyBGUJPVMBMTYIJF-UHFFFAOYSA-N
Inchi IDInChI=1S/C25H25FN6S/c26-19-8-10-21-17(15-19)7-9-23(29-21)24-30-31-25(32(24)13-4-3-12-27)33-14-11-18-16-28-22-6-2-1-5-20(18)22/h1-2,5-10,15-16,28H,3-4,11-14,27H2
PubChem CID44397472
ChEMBLCHEMBL364418
IUPHARN/A
BindingDB50169469
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand satisfies Lipinski's rule of five.

Known GPCRs

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Total entries: 2
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
23433Somatostatin receptor type 2P30874SSTR2Homo sapiens (Human)369
23432Somatostatin receptor type 5P35346SSTR5Homo sapiens (Human)364

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