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Compound Detail

CHEMBL1818245

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Cc1c2ccncc2c(C)c2c1[nH]c1cc(F)ccc12
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1818245
Phase Preclinical
Structure Type MOL
InChI Key MQDHITIYIXDZGP-UHFFFAOYSA-N
0
Targets
1
Activities
1
Assay Types
0
PK Parameters
3
Publications
0
Known Names

Molecular Properties

264.3
MW (Da)
4.63
ALogP
1
HBA
1
HBD
28.7
PSA (Ų)
0.49
QED
0
Ro5 Violations
0
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C17H13FN2
MW 264.30
Aromatic Rings 4
Heavy Atoms 20
NP-Likeness -0.12

Activity Summary

IC50 1 meas.

Literature References

PubMed DOI Target Context # Activities
21831641 10.1016/j.bmc.2011.07.020 Escherichia coli 2
21831641 10.1016/j.bmc.2011.07.020 Staphylococcus aureus 2
21831641 10.1016/j.bmc.2011.07.020 Unchecked 1

Data from ChEMBL 36 via Core Engine