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Compound Detail

CHEMBL1185325

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NS(=O)(=O)c1nnc(NS(=O)(=O)c2ccc(-[n+]3c(-c4ccccc4)cccc3-c3ccccc3)cc2)s1

Basic Information

ChEMBL ID CHEMBL1185325
Phase Preclinical
Structure Type MOL
InChI Key OZFRFGQPSWWRFN-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

550.7
MW (Da)
3.60
ALogP
7
HBA
2
HBD
136.0
PSA (Ų)
0.30
QED
1
Ro5 Violations
7
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C25H20N5O4S3+
MW 550.67
Aromatic Rings 5
Heavy Atoms 37
NP-Likeness -1.26

Data from ChEMBL 36 via Core Engine