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Ligand

NameCHEMBL3945769
Molecular formulaC24H29N5O3S
IUPAC nameN-[4-(2-cyanopyrrol-1-yl)-1-(4-methylpiperidin-1-yl)-1-oxobutan-2-yl]-1-methylindole-4-sulfonamide
Molecular weight467.588
Hydrogen bond acceptor5
Hydrogen bond donor1
XlogP2.6
SynonymsBDBM50199080
SCHEMBL1311315
Inchi KeyGJBZOFJQFQXZEW-UHFFFAOYSA-N
Inchi IDInChI=1S/C24H29N5O3S/c1-18-8-14-29(15-9-18)24(30)21(11-16-28-12-4-5-19(28)17-25)26-33(31,32)23-7-3-6-22-20(23)10-13-27(22)2/h3-7,10,12-13,18,21,26H,8-9,11,14-16H2,1-2H3
PubChem CID58508974
ChEMBLCHEMBL3945769
IUPHARN/A
BindingDBN/A
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: 2
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
538400C-C chemokine receptor type 10P46092CCR10Homo sapiens (Human)362
538401C-C chemokine receptor type 10Q9JL21Ccr10Mus musculus (Mouse)362

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