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SMILES: OC(=O)[C@]1(C[C@@H](C1)c1c(C2CCOCC2)n(-c2ccc(F)c(Cl)c2)c2ccc(O)cc12)C(F)(F)F

InChI Key:

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Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 629188   
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
Alpha-1-antitrypsin


(Human)		BDBM629188
PNG
(US20230339915, Compound 37)
Show SMILES OC(=O)[C@]1(C[C@@H](C1)c1c(C2CCOCC2)n(-c2ccc(F)c(Cl)c2)c2ccc(O)cc12)C(F)(F)F |r,wU:3.2,wD:5.7,3.35,(.3,-6.44,;1.14,-5.15,;2.68,-5.23,;.44,-3.77,;-.26,-2.4,;1.11,-1.7,;1.81,-3.07,;1.59,-.24,;.68,1.01,;-.86,1.01,;-1.63,-.33,;-3.17,-.33,;-3.94,1.01,;-3.17,2.34,;-1.63,2.34,;1.59,2.25,;1.11,3.72,;2.14,4.86,;1.67,6.33,;.16,6.65,;-.32,8.11,;-.87,5.5,;-2.38,5.82,;-.39,4.04,;3.05,1.78,;4.39,2.55,;5.72,1.78,;5.72,.24,;7.05,-.53,;4.39,-.53,;3.05,.24,;-.93,-4.47,;-2.31,-5.17,;-1.63,-3.1,;-.23,-5.84,)|
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
n/an/a>5.00E+3n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair