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Ligand

NameCHEMBL3730468
Molecular formulaC28H29FN6O5S
IUPAC nameN-[7-(4-fluoro-2-methylanilino)-6-(4-phenylpiperidine-1-carbonyl)pyrazolo[1,5-a]pyrimidin-3-yl]sulfonyl-2-methoxyacetamide
Molecular weight580.635
Hydrogen bond acceptor9
Hydrogen bond donor2
XlogP3.5
SynonymsSCHEMBL15915688
Inchi KeyKGCXJIYAQXLRMF-UHFFFAOYSA-N
Inchi IDInChI=1S/C28H29FN6O5S/c1-18-14-21(29)8-9-23(18)32-26-22(28(37)34-12-10-20(11-13-34)19-6-4-3-5-7-19)15-30-27-24(16-31-35(26)27)41(38,39)33-25(36)17-40-2/h3-9,14-16,20,32H,10-13,17H2,1-2H3,(H,33,36)
PubChem CID90313034
ChEMBLCHEMBL3730468
IUPHARN/A
BindingDBN/A
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand is heavier than 500 daltons.

Known GPCRs

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Total entries: 1
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GLASS IDNameUniProtGeneSpeciesLength
526298C-C chemokine receptor type 10P46092CCR10Homo sapiens (Human)362

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