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Ligand

NameCHEMBL3416871
Molecular formulaC20H18ClN3O2
IUPAC name(6-chloro-1H-indol-3-yl)-spiro[1H-furo[3,4-c]pyridine-3,4'-piperidine]-1'-ylmethanone
Molecular weight367.833
Hydrogen bond acceptor3
Hydrogen bond donor1
XlogP2.3
SynonymsBDBM50077274
SCHEMBL2513421
Inchi KeyRMKRYUKAFCDHJF-UHFFFAOYSA-N
Inchi IDInChI=1S/C20H18ClN3O2/c21-14-1-2-15-16(10-23-18(15)9-14)19(25)24-7-4-20(5-8-24)17-11-22-6-3-13(17)12-26-20/h1-3,6,9-11,23H,4-5,7-8,12H2
PubChem CID25001929
ChEMBLCHEMBL3416871
IUPHARN/A
BindingDB50077274
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: 2
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
453588Vasopressin V1a receptorQ62463Avpr1aMus musculus (Mouse)423
453589Vasopressin V1a receptorP37288AVPR1AHomo sapiens (Human)418

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