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Ligand

NameCHEMBL3143958
Molecular formulaC34H37Cl4N5O4
IUPAC name4-[(E)-3-[[2-[2,4-dichloro-3-[[4-(dimethylamino)-2-methylquinolin-8-yl]oxymethyl]-N-methylanilino]-2-oxoethyl]amino]-3-oxoprop-1-enyl]-N,N-dimethylbenzamide;dihydrochloride
Molecular weight721.501
Hydrogen bond acceptor6
Hydrogen bond donor3
XlogPNone
SynonymsN/A
Inchi KeyBWYMXSFNCKZNAY-CWQUOYFRSA-N
Inchi IDInChI=1S/C34H35Cl2N5O4.2ClH/c1-21-18-28(39(2)3)24-8-7-9-29(33(24)38-21)45-20-25-26(35)15-16-27(32(25)36)41(6)31(43)19-37-30(42)17-12-22-10-13-23(14-11-22)34(44)40(4)5;;/h7-18H,19-20H2,1-6H3,(H,37,42);2*1H/b17-12+;;
PubChem CID90663669
ChEMBLCHEMBL3143958
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
34875B2 bradykinin receptorO70526BDKRB2Cavia porcellus (Guinea pig)372
34876B2 bradykinin receptorP30411BDKRB2Homo sapiens (Human)391

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