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Ligand

NameCHEMBL590349
Molecular formulaC19H20ClN5O3
IUPAC name5-[3-[3-(2-chlorophenoxy)azetidin-1-yl]-5-(methoxymethyl)-1,2,4-triazol-4-yl]-2-methoxypyridine
Molecular weight401.851
Hydrogen bond acceptor7
Hydrogen bond donor0
XlogP2.6
SynonymsBDBM50305522
5-(3-(3-(2-chlorophenoxy)azetidin-1-yl)-5-(methoxymethyl)-4H-1,2,4-triazol-4-yl)-2-methoxypyridine
Inchi KeyCRPOHCGFYLWZQB-UHFFFAOYSA-N
Inchi IDInChI=1S/C19H20ClN5O3/c1-26-12-17-22-23-19(25(17)13-7-8-18(27-2)21-9-13)24-10-14(11-24)28-16-6-4-3-5-15(16)20/h3-9,14H,10-12H2,1-2H3
PubChem CID46225117
ChEMBLCHEMBL590349
IUPHARN/A
BindingDB50305522
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: 3
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
49000Oxytocin receptorP30559OXTRHomo sapiens (Human)389
48999Vasopressin V1a receptorP37288AVPR1AHomo sapiens (Human)418
48998Vasopressin V2 receptorP30518AVPR2Homo sapiens (Human)371

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