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Ligand

NameCHEMBL3416870
Molecular formulaC20H18ClN3O2
IUPAC name(6-chloro-1H-indol-3-yl)-spiro[5H-furo[3,4-b]pyridine-7,4'-piperidine]-1'-ylmethanone
Molecular weight367.833
Hydrogen bond acceptor3
Hydrogen bond donor1
XlogP2.4
SynonymsBDBM50077309
SCHEMBL2514271
Inchi KeyLWINSKSAAQRWTC-UHFFFAOYSA-N
Inchi IDInChI=1S/C20H18ClN3O2/c21-14-3-4-15-16(11-23-17(15)10-14)19(25)24-8-5-20(6-9-24)18-13(12-26-20)2-1-7-22-18/h1-4,7,10-11,23H,5-6,8-9,12H2
PubChem CID24997177
ChEMBLCHEMBL3416870
IUPHARN/A
BindingDB50077309
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
449485Vasopressin V1a receptorQ62463Avpr1aMus musculus (Mouse)423
449486Vasopressin V1a receptorP37288AVPR1AHomo sapiens (Human)418

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