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Ligand

NameCHEMBL3728619
Molecular formulaC27H26ClF2N7O4S
IUPAC name1-[7-(2-chloro-5-fluoroanilino)-6-[4-(4-fluorophenyl)piperidine-1-carbonyl]pyrazolo[1,5-a]pyrimidin-3-yl]sulfonyl-3-ethylurea
Molecular weight618.057
Hydrogen bond acceptor9
Hydrogen bond donor3
XlogP4.2
SynonymsSCHEMBL14471763
Inchi KeyPNLQWQHJYHATSX-UHFFFAOYSA-N
Inchi IDInChI=1S/C27H26ClF2N7O4S/c1-2-31-27(39)35-42(40,41)23-15-33-37-24(34-22-13-19(30)7-8-21(22)28)20(14-32-25(23)37)26(38)36-11-9-17(10-12-36)16-3-5-18(29)6-4-16/h3-8,13-15,17,34H,2,9-12H2,1H3,(H2,31,35,39)
PubChem CID53377813
ChEMBLCHEMBL3728619
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
529097C-C chemokine receptor type 10P46092CCR10Homo sapiens (Human)362

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