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Ligand

NameMLS000730667
Molecular formulaC19H26ClN3O2
IUPAC name2-(1-adamantyl)-4-chloro-5-(oxolan-2-ylmethylamino)pyridazin-3-one
Molecular weight363.886
Hydrogen bond acceptor4
Hydrogen bond donor1
XlogP3.6
Synonyms2-(1-adamantyl)-4-chloro-5-(tetrahydrofurfurylamino)pyridazin-3-one
cid_16193721
AKOS000481079
2-(1-adamantyl)-4-chloro-5-(2-oxolanylmethylamino)-3-pyridazinone
SR-01000124935
[ Show all ]
Inchi KeyAHXHATFSBJZLMF-UHFFFAOYSA-N
Inchi IDInChI=1S/C19H26ClN3O2/c20-17-16(21-10-15-2-1-3-25-15)11-22-23(18(17)24)19-7-12-4-13(8-19)6-14(5-12)9-19/h11-15,21H,1-10H2
PubChem CID16193721
ChEMBLCHEMBL1523593
IUPHARN/A
BindingDB97105
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
5954Galanin receptor type 3O60755GALR3Homo sapiens (Human)368

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