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BDBM100058 MLS000718244::N-cyclopentyl-2-(4-fluorophenyl)-3-imidazo[1,2-a]pyrazinamine::N-cyclopentyl-2-(4-fluorophenyl)imidazo[1,2-a]pyrazin-3-amine::SMR000290512::cid_4114964::cyclopentyl-[2-(4-fluorophenyl)imidazo[1,2-a]pyrazin-3-yl]amine

SMILES: Fc1ccc(cc1)-c1nc2cnccn2c1NC1CCCC1

InChI Key: InChIKey=XVXCBOREIQJWKT-UHFFFAOYSA-N

Data: 1 EC50

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   Substructure
Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 100058   
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
Kallikrein 7


(Homo sapiens (Human))
BDBM100058
PNG
(MLS000718244 | N-cyclopentyl-2-(4-fluorophenyl)-3-...)
Show SMILES Fc1ccc(cc1)-c1nc2cnccn2c1NC1CCCC1
Show InChI InChI=1S/C17H17FN4/c18-13-7-5-12(6-8-13)16-17(20-14-3-1-2-4-14)22-10-9-19-11-15(22)21-16/h5-11,14,20H,1-4H2
PDB
MMDB

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PC cid
PC sid
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Similars

PCBioAssay
n/an/an/an/a>7.72E+3n/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay




PubChem Bioassay (2013)


BindingDB Entry DOI: 10.7270/Q29G5KF0
More data for this
Ligand-Target Pair