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Ligand

NameL-162,313
Molecular formulaC30H38N4O4S2
IUPAC namebutyl N-[3-[4-[(2-ethyl-5,7-dimethylimidazo[4,5-b]pyridin-3-yl)methyl]phenyl]-5-(2-methylpropyl)thiophen-2-yl]sulfonylcarbamate
Molecular weight582.778
Hydrogen bond acceptor7
Hydrogen bond donor1
XlogP7.6
SynonymsBDBM50049189
CHEMBL288174
NCGC00015596-01
SMR001230801
3-[4-(2-Ethyl-57-dimethyl-imidazo[45-b]pyridin-3-ylmethyl)-phenyl]-5-isobutyl-thiophene-2-sulfonic acid butyloxycarbonylamide(L-162313)
[ Show all ]
Inchi KeyRINPELQWLUGERM-UHFFFAOYSA-N
Inchi IDInChI=1S/C30H38N4O4S2/c1-7-9-14-38-30(35)33-40(36,37)29-25(17-24(39-29)15-19(3)4)23-12-10-22(11-13-23)18-34-26(8-2)32-27-20(5)16-21(6)31-28(27)34/h10-13,16-17,19H,7-9,14-15,18H2,1-6H3,(H,33,35)
PubChem CID6603900
ChEMBLCHEMBL288174
IUPHAR3936
BindingDB50049189
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: 9
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
453468D(1A) dopamine receptorP21728DRD1Homo sapiens (Human)446
296995Muscarinic acetylcholine receptor M1P08482Chrm1Rattus norvegicus (Rat)460
297000Neuropeptide S receptorQ6W5P4NPSR1Homo sapiens (Human)371
297001Thyrotropin receptorP16473TSHRHomo sapiens (Human)764
296997Type-1 angiotensin II receptorP30556AGTR1Homo sapiens (Human)359
297002Type-1 angiotensin II receptorP30555AGTR1Sus scrofa (Pig)359
296998Type-1A angiotensin II receptorP25095Agtr1Rattus norvegicus (Rat)359
296996Type-2 angiotensin II receptorP35351Agtr2Rattus norvegicus (Rat)363
296999Type-2 angiotensin II receptorP50052AGTR2Homo sapiens (Human)363

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