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Ligand

NameCHEMBL3731775
Molecular formulaC30H29ClN6O5S
IUPAC nameN-[7-(4-chloro-2-methylanilino)-6-(spiro[1H-2-benzofuran-3,4'-piperidine]-1'-carbonyl)pyrazolo[1,5-a]pyrimidin-3-yl]sulfonylcyclopropanecarboxamide
Molecular weight621.109
Hydrogen bond acceptor8
Hydrogen bond donor2
XlogP3.7
SynonymsSCHEMBL15919251
Inchi KeyDQQQPEZKICVZRY-UHFFFAOYSA-N
Inchi IDInChI=1S/C30H29ClN6O5S/c1-18-14-21(31)8-9-24(18)34-26-22(15-32-27-25(16-33-37(26)27)43(40,41)35-28(38)19-6-7-19)29(39)36-12-10-30(11-13-36)23-5-3-2-4-20(23)17-42-30/h2-5,8-9,14-16,19,34H,6-7,10-13,17H2,1H3,(H,35,38)
PubChem CID90315919
ChEMBLCHEMBL3731775
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
523507C-C chemokine receptor type 10P46092CCR10Homo sapiens (Human)362

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