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Ligand

NameCHEMBL3215979
Molecular formulaC34H34Cl6N6O4
IUPAC name4-[(E)-3-[[2-[2,4-dichloro-3-[(4-imidazol-1-yl-2-methylquinolin-8-yl)oxymethyl]-N-methylanilino]-2-oxoethyl]amino]-3-oxoprop-1-enyl]-N-methylbenzamide;tetrahydrochloride
Molecular weight803.384
Hydrogen bond acceptor6
Hydrogen bond donor6
XlogPNone
SynonymsN/A
Inchi KeyGHJINNOSXOBIKA-GPZOHOMCSA-N
Inchi IDInChI=1S/C34H30Cl2N6O4.4ClH/c1-21-17-28(42-16-15-38-20-42)24-5-4-6-29(33(24)40-21)46-19-25-26(35)12-13-27(32(25)36)41(3)31(44)18-39-30(43)14-9-22-7-10-23(11-8-22)34(45)37-2;;;;/h4-17,20H,18-19H2,1-3H3,(H,37,45)(H,39,43);4*1H/b14-9+;;;;
PubChem CID90664530
ChEMBLCHEMBL3215979
IUPHARN/A
BindingDBN/A
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand has more than 5 hydrogen bond donor.
This 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
96538B2 bradykinin receptorP30411BDKRB2Homo sapiens (Human)391
96539B2 bradykinin receptorO70526BDKRB2Cavia porcellus (Guinea pig)372

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