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Ligand

NameCHEMBL3732344
Molecular formulaC28H25ClF4N6O4S
IUPAC nameN-[7-[2-chloro-5-(trifluoromethyl)anilino]-6-[4-(4-fluorophenyl)piperidine-1-carbonyl]pyrazolo[1,5-a]pyrimidin-3-yl]sulfonylpropanamide
Molecular weight653.05
Hydrogen bond acceptor11
Hydrogen bond donor2
XlogP5.3
SynonymsSCHEMBL14471862
IZNAAPQWDYCIMT-UHFFFAOYSA-N
N-{7-(2-chloro-5-trifluoromethylphenylamino)-6-[4-(4-fluorophenyl)piperidine-1-carbonyl]pyrazolo[1,5-a]pyrimidin-3-ylsulfonyl}propionamide
Inchi KeyIZNAAPQWDYCIMT-UHFFFAOYSA-N
Inchi IDInChI=1S/C28H25ClF4N6O4S/c1-2-24(40)37-44(42,43)23-15-35-39-25(36-22-13-18(28(31,32)33)5-8-21(22)29)20(14-34-26(23)39)27(41)38-11-9-17(10-12-38)16-3-6-19(30)7-4-16/h3-8,13-15,17,36H,2,9-12H2,1H3,(H,37,40)
PubChem CID71178997
ChEMBLCHEMBL3732344
IUPHARN/A
BindingDBN/A
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand has more than 10 hydrogen bond acceptor.
This ligand is heavier than 500 daltons.
This ligand has a partition coefficient log P greater than 5.

Known GPCRs

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Total entries: 1
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GLASS IDNameUniProtGeneSpeciesLength
525709C-C chemokine receptor type 10P46092CCR10Homo sapiens (Human)362

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