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Ligand

NameCHEMBL374979
Molecular formulaC27H29N3O4S
IUPAC nameN-[4-[[1-(cyclopropanecarbonyl)piperidin-4-yl]sulfamoyl]naphthalen-1-yl]-2-methylbenzamide
Molecular weight491.606
Hydrogen bond acceptor5
Hydrogen bond donor2
XlogP3.8
SynonymsBDBM50203925
N-[4-(1-cyclopropanecarbonyl-piperidin-4-ylsulfamoyl)-naphthalen-1-yl]-2-methyl-benzamide
SCHEMBL1339481
Inchi KeyIXUDWCMFQZXPGK-UHFFFAOYSA-N
Inchi IDInChI=1S/C27H29N3O4S/c1-18-6-2-3-7-21(18)26(31)28-24-12-13-25(23-9-5-4-8-22(23)24)35(33,34)29-20-14-16-30(17-15-20)27(32)19-10-11-19/h2-9,12-13,19-20,29H,10-11,14-17H2,1H3,(H,28,31)
PubChem CID16105876
ChEMBLCHEMBL374979
IUPHARN/A
BindingDB50203925
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand satisfies Lipinski's rule of five.

Known GPCRs

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Total entries: 1
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GLASS IDNameUniProtGeneSpeciesLength
144282C-C chemokine receptor type 8P51685CCR8Homo sapiens (Human)355

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