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Ligand

NameCHEMBL3890608
Molecular formulaC23H27N5O3S
IUPAC nameN-[4-(2-cyanopyrrol-1-yl)-1-(3-methylpiperidin-1-yl)-1-oxobutan-2-yl]-1H-indole-4-sulfonamide
Molecular weight453.561
Hydrogen bond acceptor5
Hydrogen bond donor2
XlogP2.6
SynonymsBDBM50199000
SCHEMBL1036426
Inchi KeyOXINRFPNXQUUAW-UHFFFAOYSA-N
Inchi IDInChI=1S/C23H27N5O3S/c1-17-5-3-13-28(16-17)23(29)21(10-14-27-12-4-6-18(27)15-24)26-32(30,31)22-8-2-7-20-19(22)9-11-25-20/h2,4,6-9,11-12,17,21,25-26H,3,5,10,13-14,16H2,1H3
PubChem CID58509216
ChEMBLCHEMBL3890608
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: 1
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GLASS IDNameUniProtGeneSpeciesLength
542684C-C chemokine receptor type 10P46092CCR10Homo sapiens (Human)362

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