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Ligand

NameSMR000623719
Molecular formulaC29H29N5O5
IUPAC name10-[4-(furan-2-carbonyl)piperazin-1-yl]-12-[4-(2-hydroxyethyl)piperazin-1-yl]-15-oxa-14-azatetracyclo[7.6.1.02,7.013,16]hexadeca-1(16),2,4,6,9,11,13-heptaen-8-one
Molecular weight527.581
Hydrogen bond acceptor9
Hydrogen bond donor1
XlogP2.6
SynonymsMLS000924890
MLS003880184
CHEMBL1308468
MolPort-007-651-622
ZINC20322431
[ Show all ]
Inchi KeyAIDOUQNAWKQKMV-UHFFFAOYSA-N
Inchi IDInChI=1S/C29H29N5O5/c35-16-15-31-7-9-33(10-8-31)22-18-21(32-11-13-34(14-12-32)29(37)23-6-3-17-38-23)24-25-26(22)30-39-28(25)20-5-2-1-4-19(20)27(24)36/h1-6,17-18,35H,7-16H2
PubChem CID20868240
ChEMBLCHEMBL1308468
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
6119Glucagon-like peptide 1 receptorP43220GLP1RHomo sapiens (Human)463

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