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Ligand

NameCHEMBL1837026
Molecular formulaC22H25N5O3
IUPAC name2-[[4-benzyl-5-(1-pyridin-2-ylpiperidin-4-yl)-1,2,4-triazol-3-yl]methoxy]acetic acid
Molecular weight407.474
Hydrogen bond acceptor7
Hydrogen bond donor1
XlogP2.0
SynonymsBDBM50354891
Inchi KeyBICJPTCSQHMIAZ-UHFFFAOYSA-N
Inchi IDInChI=1S/C22H25N5O3/c28-21(29)16-30-15-20-24-25-22(27(20)14-17-6-2-1-3-7-17)18-9-12-26(13-10-18)19-8-4-5-11-23-19/h1-8,11,18H,9-10,12-16H2,(H,28,29)
PubChem CID22017582
ChEMBLCHEMBL1837026
IUPHARN/A
BindingDB50354891
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
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
24338Vasopressin V1a receptorP37288AVPR1AHomo sapiens (Human)418

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