Compound ID | 1806

Update compound information

MRL-494

Class: BamA inhibitor

Spectrum of activity: Gram-positive  &  Gram-negative
Details of activity: Inhibits OMP assembly in Gram-negative bacteria and permeabilizes the cytoplasmic membrane of Gram-positive bacteria
Description: Synthetic compound
Institute where first reported: Merck
Year first mentioned: 2019
Highest developmental phase: Preclinical
Development status: Inactive (as of 2022)
Chemical structure(s):
Click here for structure editor
Molecular weight: 622.66
Iso. SMILES: C1CC1C(CC(=O)N=C(N)N)NC2=NC(=NC(=N2)NC3CCC(CC3)NC(=O)CN4N=C(N=N4)C5=CC=C(C=C5)F)N=C(N)N
InChI Key: COTWKBGJQJEJHE-UHFFFAOYSA-N
Can. SMILES: C1CC1C(CC(=O)N=C(N)N)NC2=NC(=NC(=N2)N=C(N)N)NC3CCC(CC3)NC(=O)CN4N=C(C5=CC=C(C=C5)F)N=N4
InChI: InChI=1S/C26H35FN16O2/c27-15-5-3-14(4-6-15)21-40-42-43(41-21)12-20(45)32-16-7-9-17(10-8-16)33-24-37-25(39-26(38-24)36-23(30)31)34-18(13-1-2-13)11-19(44)35-22(28)29/h3-6,13,16-18H,1-2,7-12H2,(H,32,45)(H4,28,29,35,44)(H6,30,31,33,34,36,37,38,39)
External links:
PubChem link: https://pubchem.ncbi.nlm.nih.gov/compound/146029710
Citations:
  • https://academic.oup.com/femsle/article/368/11/fnab059/6287571
  • https://www.pnas.org/doi/10.1073/pnas.1912345116

    • AntibioticDB is supported by GARDP.

    If you have feedback, experience problems, or are interested in a collaboration, please contact us. | Terms and conditions

    The content of this site is intended for educational and scientific research purposes only and not as a source of medical advice or consultation.