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Ligand

NameSCHEMBL2796894
Molecular formulaC22H37N3O2
IUPAC name(4-cyclopentylpiperazin-1-yl)-[6-(oxan-4-yl)-6-azaspiro[2.5]octan-2-yl]methanone
Molecular weight375.557
Hydrogen bond acceptor4
Hydrogen bond donor0
XlogP2.0
SynonymsCHEMBL3127701
ALQZUQZQVVJRCB-UHFFFAOYSA-N
(4-cyclopentylpiperazin-1-yl)(6-(tetrahydro-2H-pyran-4-yl)-6-azaspiro[2.5]octan-1-yl)methanone
Inchi KeyALQZUQZQVVJRCB-UHFFFAOYSA-N
Inchi IDInChI=1S/C22H37N3O2/c26-21(25-13-11-24(12-14-25)18-3-1-2-4-18)20-17-22(20)7-9-23(10-8-22)19-5-15-27-16-6-19/h18-20H,1-17H2
PubChem CID25118127
ChEMBLCHEMBL3127701
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
8526Histamine H3 receptorQ9Y5N1HRH3Homo sapiens (Human)445

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