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Ligand

NameCHEMBL111749
Molecular formulaC21H26ClN3O2
IUPAC nameN-[(3R,4S)-1-benzyl-4-methylpyrrolidin-3-yl]-5-chloro-2-methoxy-4-(methylamino)benzamide
Molecular weight387.908
Hydrogen bond acceptor4
Hydrogen bond donor2
XlogP3.9
SynonymsBDBM50132703
N-((3R,4S)-1-Benzyl-4-methyl-pyrrolidin-3-yl)-5-chloro-2-methoxy-4-methylamino-benzamide
N-[(3R)-1-Benzyl-4beta-methyl-3alpha-pyrrolidinyl]-2-methoxy-4-(methylamino)-5-chlorobenzamide
Inchi KeyDCJWAUUNGWWIFD-LIRRHRJNSA-N
Inchi IDInChI=1S/C21H26ClN3O2/c1-14-11-25(12-15-7-5-4-6-8-15)13-19(14)24-21(26)16-9-17(22)18(23-2)10-20(16)27-3/h4-10,14,19,23H,11-13H2,1-3H3,(H,24,26)/t14-,19-/m0/s1
PubChem CID44340097
ChEMBLCHEMBL111749
IUPHARN/A
BindingDB50132703
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
56423D(1A) dopamine receptorQ95136DRD1Bos taurus (Bovine)446
56420D(2) dopamine receptorP14416DRD2Homo sapiens (Human)443
56422D(3) dopamine receptorP35462DRD3Homo sapiens (Human)400
56421D(4) dopamine receptorP21917DRD4Homo sapiens (Human)467

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