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Ligand

NameCHEMBL2018872
Molecular formulaC32H26Cl2F2N4O3S
IUPAC name2-[5-(3,4-dichlorophenyl)sulfonyl-8,10-difluoro-6H-phenanthridin-6-yl]-N-[2-[4-(4,5-dihydro-1H-imidazol-2-yl)phenyl]ethyl]acetamide
Molecular weight655.542
Hydrogen bond acceptor7
Hydrogen bond donor2
XlogP5.5
SynonymsBDBM50381266
Inchi KeyDWYMCXLNHQBOCL-UHFFFAOYSA-N
Inchi IDInChI=1S/C32H26Cl2F2N4O3S/c33-25-10-9-22(17-26(25)34)44(42,43)40-28-4-2-1-3-23(28)31-24(15-21(35)16-27(31)36)29(40)18-30(41)37-12-11-19-5-7-20(8-6-19)32-38-13-14-39-32/h1-10,15-17,29H,11-14,18H2,(H,37,41)(H,38,39)
PubChem CID23627523
ChEMBLCHEMBL2018872
IUPHARN/A
BindingDB50381266
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand is heavier than 500 daltons.
This ligand has a partition coefficient log P greater than 5.

Known GPCRs

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Total entries: 2
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
71055B1 bradykinin receptorP97583Bdkrb1Rattus norvegicus (Rat)337
71056B1 bradykinin receptorP46663BDKRB1Homo sapiens (Human)353

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