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Ligand

NameCHEMBL241935
Molecular formulaC24H26BrClN6O2
IUPAC name4-bromo-5-[(2-chlorobenzoyl)amino]-2-methyl-N-[2-(1-pyridin-4-ylpiperidin-4-yl)ethyl]pyrazole-3-carboxamide
Molecular weight545.866
Hydrogen bond acceptor5
Hydrogen bond donor2
XlogP4.2
SynonymsBDBM50222651
SCHEMBL6045810
4-bromo-3-[(2-chlorobenzoyl)amino]-1-methyl-N-[2-[1-(4-pyridinyl)-4-piperidinyl]ethyl]-1H-pyrazole-5-carboxamide
Inchi KeyASAUYKLLTQQFHN-UHFFFAOYSA-N
Inchi IDInChI=1S/C24H26BrClN6O2/c1-31-21(20(25)22(30-31)29-23(33)18-4-2-3-5-19(18)26)24(34)28-13-6-16-9-14-32(15-10-16)17-7-11-27-12-8-17/h2-5,7-8,11-12,16H,6,9-10,13-15H2,1H3,(H,28,34)(H,29,30,33)
PubChem CID23630612
ChEMBLCHEMBL241935
IUPHARN/A
BindingDB50222651
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand is heavier than 500 daltons.

Known GPCRs

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Total entries: 1
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
12967B1 bradykinin receptorP46663BDKRB1Homo sapiens (Human)353

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