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Ligand

NameCHEMBL3731438
Molecular formulaC28H30FN7O4S
IUPAC name1-ethyl-3-[7-(4-fluoro-2-methylanilino)-6-(4-phenylpiperidine-1-carbonyl)pyrazolo[1,5-a]pyrimidin-3-yl]sulfonylurea
Molecular weight579.651
Hydrogen bond acceptor8
Hydrogen bond donor3
XlogP3.9
SynonymsSCHEMBL15914694
Inchi KeyFYLJRLSNUYZMFA-UHFFFAOYSA-N
Inchi IDInChI=1S/C28H30FN7O4S/c1-3-30-28(38)34-41(39,40)24-17-32-36-25(33-23-10-9-21(29)15-18(23)2)22(16-31-26(24)36)27(37)35-13-11-20(12-14-35)19-7-5-4-6-8-19/h4-10,15-17,20,33H,3,11-14H2,1-2H3,(H2,30,34,38)
PubChem CID90312312
ChEMBLCHEMBL3731438
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
524127C-C chemokine receptor type 10P46092CCR10Homo sapiens (Human)362

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