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Ligand

NameCHEMBL2204937
Molecular formulaC27H23FN8O
IUPAC name3-[(1S,3S)-3-[5-(4-fluorophenyl)-1H-imidazol-2-yl]-1-(1-methylpyrazol-4-yl)-2,3,4,9-tetrahydropyrido[3,4-b]indol-1-yl]-5-methyl-1,2,4-oxadiazole
Molecular weight494.534
Hydrogen bond acceptor7
Hydrogen bond donor3
XlogP3.1
SynonymsBDBM50400526
Inchi KeyNTIFDLOQPKMIJK-CUNXSJBXSA-N
Inchi IDInChI=1S/C27H23FN8O/c1-15-31-26(35-37-15)27(17-12-30-36(2)14-17)24-20(19-5-3-4-6-21(19)32-24)11-22(34-27)25-29-13-23(33-25)16-7-9-18(28)10-8-16/h3-10,12-14,22,32,34H,11H2,1-2H3,(H,29,33)/t22-,27-/m0/s1
PubChem CID71450468
ChEMBLCHEMBL2204937
IUPHARN/A
BindingDB50400526
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
231530Somatostatin receptor type 3P30935Sstr3Mus musculus (Mouse)428
231531Somatostatin receptor type 3P32745SSTR3Homo sapiens (Human)418

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