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Ligand

NameSCHEMBL1356029
Molecular formulaC34H33ClFN3O3S
IUPAC name3-[[4-[(2S)-1-(4-chlorophenyl)-1-[5-fluoro-7-(2-methylpyrazol-3-yl)-1-benzothiophen-3-yl]hexan-2-yl]benzoyl]amino]propanoic acid
Molecular weight618.164
Hydrogen bond acceptor6
Hydrogen bond donor2
XlogP8.0
SynonymsN-[4-((1S)-1-{(4-Chlorophenyl)[5-fluoro-7-(1-methyl-1H-pyrazol-5-yl)-1-benzothien-3-yl]methyl}pentyl)benzoyl]-beta-alanine
AQUZMSQNDJPTEI-PSPFREQMSA-N
BDBM235125
US9359339, 2
Inchi KeyAQUZMSQNDJPTEI-PSPFREQMSA-N
Inchi IDInChI=1S/C34H33ClFN3O3S/c1-3-4-5-26(21-6-8-23(9-7-21)34(42)37-16-15-31(40)41)32(22-10-12-24(35)13-11-22)29-20-43-33-27(29)18-25(36)19-28(33)30-14-17-38-39(30)2/h6-14,17-20,26,32H,3-5,15-16H2,1-2H3,(H,37,42)(H,40,41)/t26-,32?/m1/s1
PubChem CID46853082
ChEMBLN/A
IUPHARN/A
BindingDB235125
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: 1
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
557633Glucagon receptorP47871GCGRHomo sapiens (Human)477

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