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SMILES: CCN(CC)c1ccc2c(-c3ccccc3C(=O)N[C@@H](CCCCN)C(=O)N(CCC(=O)N[C@@H](CCCCN)C(=O)N(CCC(=O)N[C@@H](CCCCN)C(=O)N(CCC(=O)N[C@@H](CCCCN)C(=O)N(CCC(=O)N[C@@H](CCCCN)C(=O)N(CCC(=O)N[C@@H](CCCCN)C(=O)N(CCC(N)=O)Cc3ccc(C)cc3)Cc3ccc(C)cc3)Cc3ccc(C)cc3)Cc3ccc(C)cc3)Cc3ccc(C)cc3)Cc3ccc(C)cc3)c3ccc(cc3oc2c1)=[N+](CC)CC

InChI Key: InChIKey=BZTSQPZNSSQDJU-JKJNWKHPSA-O

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50238909   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
N-formyl peptide receptor 2


(Homo sapiens (Human))
BDBM50238909
PNG
(CHEMBL4062611)
Show SMILES CCN(CC)c1ccc2c(-c3ccccc3C(=O)N[C@@H](CCCCN)C(=O)N(CCC(=O)N[C@@H](CCCCN)C(=O)N(CCC(=O)N[C@@H](CCCCN)C(=O)N(CCC(=O)N[C@@H](CCCCN)C(=O)N(CCC(=O)N[C@@H](CCCCN)C(=O)N(CCC(=O)N[C@@H](CCCCN)C(=O)N(CCC(N)=O)Cc3ccc(C)cc3)Cc3ccc(C)cc3)Cc3ccc(C)cc3)Cc3ccc(C)cc3)Cc3ccc(C)cc3)Cc3ccc(C)cc3)c3ccc(cc3oc2c1)=[N+](CC)CC |r,wU:89.90,47.48,61.62,33.34,wD:75.76,19.20,(18.68,-25.46,;17.36,-24.7,;16.03,-25.47,;16.03,-27.01,;17.36,-27.78,;14.68,-24.7,;14.68,-23.17,;13.35,-22.41,;12.02,-23.18,;10.69,-22.41,;10.68,-20.36,;9.34,-19.6,;9.34,-18.06,;10.67,-17.27,;11.99,-18.05,;11.99,-19.58,;13.32,-20.36,;13.32,-21.91,;14.68,-19.58,;16.03,-20.36,;16.03,-21.91,;17.35,-22.68,;17.35,-24.21,;18.69,-24.98,;20.02,-24.21,;17.37,-19.58,;17.37,-18.01,;18.71,-20.36,;18.72,-21.89,;20.05,-22.65,;21.38,-21.88,;21.38,-20.34,;22.71,-22.65,;24.04,-21.88,;24.04,-20.33,;25.37,-19.55,;25.37,-18.01,;26.7,-17.24,;26.69,-15.71,;25.38,-22.64,;25.38,-24.17,;26.71,-21.87,;28.04,-22.64,;28.04,-24.17,;29.38,-24.93,;30.71,-24.16,;29.38,-26.47,;30.72,-27.24,;32.05,-26.47,;33.37,-27.23,;34.71,-26.46,;36.05,-27.23,;37.37,-26.45,;30.72,-28.77,;29.39,-29.55,;32.05,-29.54,;32.06,-31.08,;30.73,-31.85,;30.73,-33.39,;32.06,-34.15,;29.4,-34.16,;29.41,-35.7,;30.74,-36.47,;30.75,-38.01,;32.08,-38.78,;33.41,-38.01,;34.76,-38.77,;28.07,-36.48,;26.73,-35.71,;28.07,-38.02,;29.42,-38.79,;29.42,-40.33,;28.08,-41.1,;26.75,-40.33,;28.08,-42.64,;26.75,-43.42,;25.42,-42.65,;24.08,-43.42,;22.74,-42.66,;21.41,-43.43,;20.08,-42.66,;26.76,-44.96,;28.09,-45.73,;25.43,-45.73,;25.43,-47.27,;24.09,-48.05,;24.09,-49.59,;25.44,-50.36,;22.76,-50.36,;22.77,-51.91,;24.1,-52.67,;24.1,-54.22,;25.45,-54.98,;26.78,-54.21,;28.11,-54.98,;21.44,-52.68,;20.1,-51.91,;21.44,-54.22,;22.77,-54.99,;22.78,-56.53,;24.11,-57.3,;24.12,-58.84,;25.45,-56.52,;20.11,-55,;18.76,-54.23,;18.77,-52.69,;17.43,-51.92,;16.1,-52.69,;14.76,-51.93,;16.11,-54.24,;17.44,-55,;24.08,-44.97,;22.75,-45.74,;21.42,-44.97,;20.09,-45.74,;20.09,-47.28,;18.76,-48.06,;21.43,-48.05,;22.76,-47.27,;26.74,-38.79,;25.41,-38.02,;25.41,-36.48,;24.07,-35.71,;22.74,-36.49,;21.4,-35.72,;22.75,-38.04,;24.08,-38.8,;33.38,-28.77,;34.71,-29.53,;34.72,-31.07,;36.05,-31.84,;37.38,-31.07,;38.72,-31.83,;37.37,-29.52,;36.04,-28.76,;26.7,-20.33,;28.03,-19.55,;28.02,-18.01,;29.35,-17.24,;30.69,-18.01,;32.02,-17.23,;30.69,-19.55,;29.37,-20.33,;20.05,-19.58,;20.04,-18.03,;18.71,-17.29,;18.7,-15.75,;20.04,-14.96,;20.03,-13.42,;21.37,-15.74,;21.38,-17.27,;9.36,-23.2,;8.03,-22.44,;6.71,-23.22,;6.73,-24.76,;8.04,-25.51,;9.36,-24.74,;10.71,-25.5,;12.03,-24.72,;13.37,-25.48,;5.38,-25.52,;5.38,-27.06,;4.04,-27.83,;4.04,-24.76,;2.7,-25.52,)|
Show InChI InChI=1S/C130H181N21O14/c1-11-144(12-2)103-61-63-107-115(83-103)165-116-84-104(145(13-3)14-4)62-64-108(116)123(107)105-29-15-16-30-106(105)124(158)143-114(36-22-28-76-136)130(164)151(90-102-59-47-96(10)48-60-102)82-70-122(157)142-113(35-21-27-75-135)129(163)150(89-101-57-45-95(9)46-58-101)81-69-121(156)141-112(34-20-26-74-134)128(162)149(88-100-55-43-94(8)44-56-100)80-68-120(155)140-111(33-19-25-73-133)127(161)148(87-99-53-41-93(7)42-54-99)79-67-119(154)139-110(32-18-24-72-132)126(160)147(86-98-51-39-92(6)40-52-98)78-66-118(153)138-109(31-17-23-71-131)125(159)146(77-65-117(137)152)85-97-49-37-91(5)38-50-97/h15-16,29-30,37-64,83-84,109-114H,11-14,17-28,31-36,65-82,85-90,131-136H2,1-10H3,(H7-,137,138,139,140,141,142,143,152,153,154,155,156,157,158)/p+1/t109-,110-,111-,112-,113-,114-/m0/s1
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Similars

Article
PubMed
n/an/a 24n/an/an/an/an/an/a



University of Copenhagen

Curated by ChEMBL


Assay Description
Antagonist activity at FPR2 in human peripheral blood polymorphonuclear neutrophils assessed as inhibition of WKYMVM-peptide induced ROS production p...


J Med Chem 60: 6991-6997 (2017)


Article DOI: 10.1021/acs.jmedchem.7b00489
BindingDB Entry DOI: 10.7270/Q2V40XFR
More data for this
Ligand-Target Pair