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BDBM139421 US8889671, 52

SMILES: C[C@@H]1CN2[C@H]([C@H](C)O1)C1(Cc3cc4c(noc4c(F)c23)N2[C@H](COC2=O)C2CC2)C(=O)NC(=O)NC1=O

InChI Key: InChIKey=SZMSWDRXNNSSFK-UYWSGAMCNA-N

Data: 1 IC50

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   Substructure
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 139421   
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
DNA Gyrase Subunit A


(Escherichia coli (strain K12))
BDBM139421
PNG
(US8889671, 52)
Show SMILES C[C@@H]1CN2[C@H]([C@H](C)O1)C1(Cc3cc4c(noc4c(F)c23)N2[C@H](COC2=O)C2CC2)C(=O)NC(=O)NC1=O
Show InChI InChI=1/C24H24FN5O7/c1-9-7-29-16-12(6-24(18(29)10(2)36-9)20(31)26-22(33)27-21(24)32)5-13-17(15(16)25)37-28-19(13)30-14(11-3-4-11)8-35-23(30)34/h5,9-11,14,18H,3-4,6-8H2,1-2H3,(H2,26,27,31,32,33)/t9-,10+,14-,18-/s2
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 900n/an/an/an/a7.5n/a



AstraZeneca AB

US Patent


Assay Description
In a black, 384-well polystyrene assay plate, 30 microliters/well of 5 nM Escherichia coli DNA gyrase A/B tetramer and 130 micrograms/mL of topologic...


US Patent US8889671 (2014)


BindingDB Entry DOI: 10.7270/Q22J69JX
More data for this
Ligand-Target Pair