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Ligand

NameMLS003119326
Molecular formulaC23H21F3N4O2S
IUPAC name1-[2-methyl-3-oxo-1-[[3-(trifluoromethyl)phenyl]methyl]indazol-5-yl]-3-(2-thiophen-2-ylethyl)urea
Molecular weight474.502
Hydrogen bond acceptor7
Hydrogen bond donor2
XlogP4.5
SynonymsSMR001275242
CHEMBL1887353
Inchi KeyAFANAZYQRRRSMI-UHFFFAOYSA-N
Inchi IDInChI=1S/C23H21F3N4O2S/c1-29-21(31)19-13-17(28-22(32)27-10-9-18-6-3-11-33-18)7-8-20(19)30(29)14-15-4-2-5-16(12-15)23(24,25)26/h2-8,11-13H,9-10,14H2,1H3,(H2,27,28,32)
PubChem CID46942939
ChEMBLCHEMBL1887353
IUPHARN/A
BindingDBN/A
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: 1
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
463371Parathyroid hormone/parathyroid hormone-related peptide receptorQ03431PTH1RHomo sapiens (Human)593

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