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Ligand

NameCHEMBL64139
Molecular formulaC23H26BrN3OS
IUPAC name1-[(3S)-1-benzylpyrrolidin-3-yl]-N-[[2-(5-bromo-2-methoxyphenyl)-1,3-thiazol-4-yl]methyl]methanamine
Molecular weight472.445
Hydrogen bond acceptor5
Hydrogen bond donor1
XlogP4.6
Synonyms2-(2-Methoxy-5-bromophenyl)-4-[[(3S)-1-benzyl-3alpha-pyrrolidinyl]methylaminomethyl]thiazole
((S)-1-Benzyl-pyrrolidin-3-ylmethyl)-[2-(5-bromo-2-methoxy-phenyl)-thiazol-4-ylmethyl]-amine
BDBM50091897
Inchi KeyFYSSSSIVDTYBFD-SFHVURJKSA-N
Inchi IDInChI=1S/C23H26BrN3OS/c1-28-22-8-7-19(24)11-21(22)23-26-20(16-29-23)13-25-12-18-9-10-27(15-18)14-17-5-3-2-4-6-17/h2-8,11,16,18,25H,9-10,12-15H2,1H3/t18-/m0/s1
PubChem CID44304603
ChEMBLCHEMBL64139
IUPHARN/A
BindingDB50091897
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: 4
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
90507D(1A) dopamine receptorQ95136DRD1Bos taurus (Bovine)446
90508D(2) dopamine receptorP14416DRD2Homo sapiens (Human)443
90505D(3) dopamine receptorP35462DRD3Homo sapiens (Human)400
90506D(4) dopamine receptorP21917DRD4Homo sapiens (Human)467

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