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Ligand

NameCHEMBL3728121
Molecular formulaC29H29ClN6O5S
IUPAC nameN-[7-(2-chloro-5-methylanilino)-6-(spiro[1H-2-benzofuran-3,4'-piperidine]-1'-carbonyl)pyrazolo[1,5-a]pyrimidin-3-yl]sulfonylpropanamide
Molecular weight609.098
Hydrogen bond acceptor8
Hydrogen bond donor2
XlogP3.7
SynonymsSCHEMBL15915048
Inchi KeyFJZQVWCJEJOGKS-UHFFFAOYSA-N
Inchi IDInChI=1S/C29H29ClN6O5S/c1-3-25(37)34-42(39,40)24-16-32-36-26(33-23-14-18(2)8-9-22(23)30)20(15-31-27(24)36)28(38)35-12-10-29(11-13-35)21-7-5-4-6-19(21)17-41-29/h4-9,14-16,33H,3,10-13,17H2,1-2H3,(H,34,37)
PubChem CID90312567
ChEMBLCHEMBL3728121
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
523868C-C chemokine receptor type 10P46092CCR10Homo sapiens (Human)362

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