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Compound Detail

CHEMBL2048346

EUDISTOMIN Y13
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OC(c1ccccc1)c1nccc2c1[nH]c1ccc(Br)cc12

Basic Information

ChEMBL ID CHEMBL2048346
Name EUDISTOMIN Y13
Phase Preclinical
Structure Type MOL
InChI Key FUINDJPWTVFMGF-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
14
Publications
0
Known Names

Molecular Properties

353.2
MW (Da)
4.56
ALogP
2
HBA
2
HBD
48.9
PSA (Ų)
0.56
QED
0
Ro5 Violations
2
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

Natural Product First in Class Prodrug

Extended Properties

Molecular Formula C18H13BrN2O
MW 353.22
Aromatic Rings 4
Heavy Atoms 22
NP-Likeness 0.23

Literature References

PubMed DOI Target Context # Activities
22652254 10.1016/j.bmc.2012.05.002 Staphylococcus aureus 1
22652254 10.1016/j.bmc.2012.05.002 Bacillus subtilis 1
22652254 10.1016/j.bmc.2012.05.002 Micrococcus luteus 1
22652254 10.1016/j.bmc.2012.05.002 Salmonella typhimurium 1
22652254 10.1016/j.bmc.2012.05.002 Proteus vulgaris 1
22652254 10.1016/j.bmc.2012.05.002 Escherichia coli 1
22652254 10.1016/j.bmc.2012.05.002 Aspergillus fumigatus 1
22652254 10.1016/j.bmc.2012.05.002 Trichophyton rubrum 1
22652254 10.1016/j.bmc.2012.05.002 Trichophyton mentagrophytes 1
22652254 10.1016/j.bmc.2012.05.002 Candida albicans 1
22652254 10.1016/j.bmc.2012.05.002 A549 1
22652254 10.1016/j.bmc.2012.05.002 Sortase A 1
22652254 10.1016/j.bmc.2012.05.002 Isocitrate lyase 1
22652254 10.1016/j.bmc.2012.05.002 Unchecked 1

Data from ChEMBL 36 via Core Engine