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Ligand

NameCHEMBL1221422
Molecular formulaC24H30ClN5O3
IUPAC name2-[6-(3-chlorophenyl)-4-oxo-2-(2-piperidin-1-ylethoxy)pyrazolo[1,5-a]pyrazin-5-yl]-N-propan-2-ylacetamide
Molecular weight471.986
Hydrogen bond acceptor5
Hydrogen bond donor1
XlogP3.5
SynonymsBDBM50416661
SCHEMBL4305714
Inchi KeyAKDJMBHEZXZXTL-UHFFFAOYSA-N
Inchi IDInChI=1S/C24H30ClN5O3/c1-17(2)26-22(31)16-29-21(18-7-6-8-19(25)13-18)15-30-20(24(29)32)14-23(27-30)33-12-11-28-9-4-3-5-10-28/h6-8,13-15,17H,3-5,9-12,16H2,1-2H3,(H,26,31)
PubChem CID44465987
ChEMBLCHEMBL1221422
IUPHARN/A
BindingDB50416661
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
7453Vasopressin V1b receptorP47901AVPR1BHomo sapiens (Human)424

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