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Ligand

NameCHEMBL538732
Molecular formulaC29H27BrCl3N5O4
IUPAC name4-[(E)-3-[[2-[3-[(3-bromo-2-methylimidazo[1,2-a]pyridin-8-yl)oxymethyl]-2,4-dichloro-N-methylanilino]-2-oxoethyl]amino]-3-oxoprop-1-enyl]-N-methylbenzamide;hydrochloride
Molecular weight695.82
Hydrogen bond acceptor5
Hydrogen bond donor3
XlogPNone
SynonymsSCHEMBL8567356
Inchi KeyCMEYURXQZDMCTC-FNXZNAJJSA-N
Inchi IDInChI=1S/C29H26BrCl2N5O4.ClH/c1-17-27(30)37-14-4-5-23(28(37)35-17)41-16-20-21(31)11-12-22(26(20)32)36(3)25(39)15-34-24(38)13-8-18-6-9-19(10-7-18)29(40)33-2;/h4-14H,15-16H2,1-3H3,(H,33,40)(H,34,38);1H/b13-8+;
PubChem CID18923352
ChEMBLCHEMBL538732
IUPHARN/A
BindingDBN/A
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand is heavier than 500 daltons.
Partition coefficient log P of this ligand is not available.

Known GPCRs

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Total entries: 2
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
45269B2 bradykinin receptorP30411BDKRB2Homo sapiens (Human)391
45270B2 bradykinin receptorO70526BDKRB2Cavia porcellus (Guinea pig)372

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