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Compound Detail

CHEMBL1617564

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CN(C)c1ccc(-c2sc(Nc3ccccc3)n[n+]2-c2ccc(F)cc2)cc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1617564
Phase Preclinical
Structure Type MOL
InChI Key VUTNIMIMFLELLA-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

391.5
MW (Da)
5.04
ALogP
4
HBA
1
HBD
32.0
PSA (Ų)
0.48
QED
1
Ro5 Violations
5
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C22H20FN4S+
MW 391.50
Aromatic Rings 4
Heavy Atoms 28
NP-Likeness -1.29

Data from ChEMBL 36 via Core Engine