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Ligand

NameCHEMBL538531
Molecular formulaC30H29BrCl3N5O4
IUPAC name(E)-3-[4-[acetyl(methyl)amino]phenyl]-N-[2-[3-[(3-bromo-2-methylimidazo[1,2-a]pyridin-8-yl)oxymethyl]-2,4-dichloro-N-methylanilino]-2-oxoethyl]prop-2-enamide;hydrochloride
Molecular weight709.847
Hydrogen bond acceptor5
Hydrogen bond donor2
XlogPNone
SynonymsSCHEMBL8565191
Inchi KeyFKQBPGYDZNKKET-KYIGKLDSSA-N
Inchi IDInChI=1S/C30H28BrCl2N5O4.ClH/c1-18-29(31)38-15-5-6-25(30(38)35-18)42-17-22-23(32)12-13-24(28(22)33)37(4)27(41)16-34-26(40)14-9-20-7-10-21(11-8-20)36(3)19(2)39;/h5-15H,16-17H2,1-4H3,(H,34,40);1H/b14-9+;
PubChem CID18923606
ChEMBLCHEMBL538531
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
80743B2 bradykinin receptorP30411BDKRB2Homo sapiens (Human)391
80744B2 bradykinin receptorO70526BDKRB2Cavia porcellus (Guinea pig)372

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