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Ligand

NameCHEMBL3314353
Molecular formulaC22H26N4O
IUPAC name[6-[(dimethylamino)methyl]-3,4-dihydro-1H-isoquinolin-2-yl]-(1,5-dimethylpyrrolo[2,3-c]pyridin-2-yl)methanone
Molecular weight362.477
Hydrogen bond acceptor3
Hydrogen bond donor0
XlogP2.5
SynonymsBDBM50045844
Inchi KeyJEWNWDVCPPSWTG-UHFFFAOYSA-N
Inchi IDInChI=1S/C22H26N4O/c1-15-9-19-11-20(25(4)21(19)12-23-15)22(27)26-8-7-17-10-16(13-24(2)3)5-6-18(17)14-26/h5-6,9-12H,7-8,13-14H2,1-4H3
PubChem CID118707554
ChEMBLCHEMBL3314353
IUPHARN/A
BindingDB50045844
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
447596Pyroglutamylated RF-amide peptide receptorQ96P65QRFPRHomo sapiens (Human)431

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