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Ligand

NameCHEMBL1651721
Molecular formulaC23H26N6O2S2
IUPAC name5-amino-N-tert-butyl-2-methylsulfanyl-4-[3-[[2-oxo-2-(prop-2-ynylamino)ethyl]amino]phenyl]thieno[2,3-d]pyrimidine-6-carboxamide
Molecular weight482.621
Hydrogen bond acceptor8
Hydrogen bond donor4
XlogP4.0
SynonymsBDBM50335467
5-amino-N-tert-butyl-2-(methylthio)-4-(3-(2-oxo-2-(prop-2-ynylamino)ethylamino)phenyl)thieno[2,3-d]pyrimidine-6-carboxamide
Inchi KeyOBTDWDIYUNCNGX-UHFFFAOYSA-N
Inchi IDInChI=1S/C23H26N6O2S2/c1-6-10-25-15(30)12-26-14-9-7-8-13(11-14)18-16-17(24)19(20(31)29-23(2,3)4)33-21(16)28-22(27-18)32-5/h1,7-9,11,26H,10,12,24H2,2-5H3,(H,25,30)(H,29,31)
PubChem CID53322111
ChEMBLCHEMBL1651721
IUPHARN/A
BindingDB50335467
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
237342Follicle-stimulating hormone receptorP23945FSHRHomo sapiens (Human)695
237341Lutropin-choriogonadotropic hormone receptorP22888LHCGRHomo sapiens (Human)699

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