Compound ID | 2142

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DS-2969b

Class: Small molecule antibacterial agent

Spectrum of activity: Gram-positive
Details of activity: Inhibits bacterial DNA gyrase (GyrB) and topoisomerase IV (ParE) by binding at the ATP-binding domain which interferes with DNA biosynthesis. Active against Gram-positive bacteria.
Description: Synthetic compound; DS11960558 is a water-soluble prodrug
Institute where first reported: Daiichi Sankyo
Year first mentioned: 2017
Highest developmental phase: Phase 1
Development status: Terminated
Chemical structure(s):
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Molecular weight: 428.94
Iso. SMILES: CCC1=C(N=C(N1)C(=O)N[C@@H]2CCN(C[C@@H]2OC)C3=NN=C(S3)C(C)(C)O)Cl
InChI Key: RFKLYBAHWNXIDR-MNOVXSKESA-N
Can. SMILES: CCC1=C(Cl)N=C(C(=O)N[C@@H]2CCN(C[C@@H]2OC)C3=NN=C(C(C)(C)O)S3)N1
InChI: InChI=1S/C17H25ClN6O3S/c1-5-9-12(18)21-13(19-9)14(25)20-10-6-7-24(8-11(10)27-4)16-23-22-15(28-16)17(2,3)26/h10-11,26H,5-8H2,1-4H3,(H,19,21)(H,20,25)/t10-,11+/m1/s1
External links:
PubChem link: https://pubchem.ncbi.nlm.nih.gov/compound/135283668
Guide to Pharmacology: DS-2969b
Citation: https://journals.asm.org/doi/10.1128/AAC.02556-17

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