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Ligand

NameCHEMBL555619
Molecular formulaC17H19NO3
IUPAC name(1R,3S)-1-(aminomethyl)-6-methoxy-3-phenyl-3,4-dihydro-1H-isochromen-5-ol
Molecular weight285.343
Hydrogen bond acceptor4
Hydrogen bond donor2
XlogP1.8
SynonymsCHEMBL1195937
(1R)-1alpha-(Aminomethyl)-3,4-dihydro-3alpha-phenyl-6-methoxy-1H-2-benzopyran-5-ol
BDBM50008830
SCHEMBL9802704
1-Aminomethyl-6-methoxy-3-phenyl-isochroman-5-ol; hydrochloride
Inchi KeyCJSINCRQHDFMNW-HOTGVXAUSA-N
Inchi IDInChI=1S/C17H19NO3/c1-20-14-8-7-12-13(17(14)19)9-15(21-16(12)10-18)11-5-3-2-4-6-11/h2-8,15-16,19H,9-10,18H2,1H3/t15-,16-/m0/s1
PubChem CID15711860
ChEMBLN/A
IUPHARN/A
BindingDB50008830
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: 3
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
558619D(1) dopamine receptorP35406Carassius auratus (Goldfish)363
43665D(1A) dopamine receptorP18901Drd1Rattus norvegicus (Rat)446
43664D(2) dopamine receptorP61169Drd2Rattus norvegicus (Rat)444

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