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Compound Detail

CHEMBL1852076

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Cc1cccc[n+]1-c1ccncc1S(N)(=O)=O
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1852076
Phase Preclinical
Structure Type MOL
InChI Key YWTLFBPFVUMTCY-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

250.3
MW (Da)
0.31
ALogP
3
HBA
1
HBD
76.9
PSA (Ų)
0.78
QED
0
Ro5 Violations
2
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C11H12N3O2S+
MW 250.30
Aromatic Rings 2
Heavy Atoms 17
NP-Likeness -0.98

Data from ChEMBL 36 via Core Engine