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Ligand

NameSCHEMBL15987713
Molecular formulaC29H37N5O4
IUPAC nameN-tert-butyl-2-[4-(3-methoxyphenyl)-1-[4-[2-(3-oxa-8-azabicyclo[3.2.1]octan-8-yl)ethyl]phenyl]-5-oxo-1,2,4-triazol-3-yl]acetamide
Molecular weight519.646
Hydrogen bond acceptor6
Hydrogen bond donor1
XlogP3.6
SynonymsUS9522914, D-07
BDBM260318
Inchi KeyAXMBUGATQYFCJJ-UHFFFAOYSA-N
Inchi IDInChI=1S/C29H37N5O4/c1-29(2,3)30-27(35)17-26-31-34(28(36)33(26)22-6-5-7-25(16-22)37-4)21-10-8-20(9-11-21)14-15-32-23-12-13-24(32)19-38-18-23/h5-11,16,23-24H,12-15,17-19H2,1-4H3,(H,30,35)
PubChem CID90370346
ChEMBLN/A
IUPHARN/A
BindingDB260318
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
557752Vasopressin V1b receptorP47901AVPR1BHomo sapiens (Human)424

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