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Ligand

NameSCHEMBL15987978
Molecular formulaC29H40N6O2
IUPAC name2-[3-[4-[2-[4-(dimethylamino)piperidin-1-yl]ethyl]phenyl]-5-(3-methoxyphenyl)-1,2,4-triazol-1-yl]-N-propan-2-ylacetamide
Molecular weight504.679
Hydrogen bond acceptor6
Hydrogen bond donor1
XlogP4.4
SynonymsUS9522914, B-26
BDBM260273
Inchi KeyATCYDGHGDDTUEW-UHFFFAOYSA-N
Inchi IDInChI=1S/C29H40N6O2/c1-21(2)30-27(36)20-35-29(24-7-6-8-26(19-24)37-5)31-28(32-35)23-11-9-22(10-12-23)13-16-34-17-14-25(15-18-34)33(3)4/h6-12,19,21,25H,13-18,20H2,1-5H3,(H,30,36)
PubChem CID71555582
ChEMBLN/A
IUPHARN/A
BindingDB260273
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
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
536354Vasopressin V1b receptorP47901AVPR1BHomo sapiens (Human)424

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