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Compound Detail

CHEMBL1194052

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NS(=O)(=O)Oc1cccc(-n2ccnc2)c1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1194052
Phase Preclinical
Structure Type MOL
InChI Key MEZDGHUSBIIOPO-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

239.3
MW (Da)
0.45
ALogP
5
HBA
1
HBD
87.2
PSA (Ų)
0.84
QED
0
Ro5 Violations
3
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C9H9N3O3S
MW 239.26
Aromatic Rings 2
Heavy Atoms 16
NP-Likeness -2.13

Data from ChEMBL 36 via Core Engine