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Ligand

NameSMR000172878
Molecular formulaC30H31N3O3S
IUPAC name2-(4-acetyl-N-[2-(1H-indol-3-yl)acetyl]anilino)-N-cyclohexyl-2-thiophen-2-ylacetamide
Molecular weight513.656
Hydrogen bond acceptor4
Hydrogen bond donor2
XlogP5.3
SynonymsAC1ML8IG
MLS000555659
CHEMBL1537944
HMS2404H09
ASN 04883021
[ Show all ]
Inchi KeyADPPBIMJWRJFOW-UHFFFAOYSA-N
Inchi IDInChI=1S/C30H31N3O3S/c1-20(34)21-13-15-24(16-14-21)33(28(35)18-22-19-31-26-11-6-5-10-25(22)26)29(27-12-7-17-37-27)30(36)32-23-8-3-2-4-9-23/h5-7,10-17,19,23,29,31H,2-4,8-9,18H2,1H3,(H,32,36)
PubChem CID3190913
ChEMBLCHEMBL1537944
IUPHARN/A
BindingDBN/A
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand is heavier than 500 daltons.
This ligand has a partition coefficient log P greater than 5.

Known GPCRs

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Total entries: 2
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
2941Glucagon-like peptide 1 receptorP43220GLP1RHomo sapiens (Human)463
2940Neuropeptide S receptorQ6W5P4NPSR1Homo sapiens (Human)371

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