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Compound Detail

CHEMBL4594844

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Nc1cc(S(=O)(=O)O)c2cccnc2c1O
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL4594844
Phase Preclinical
Structure Type MOL
InChI Key BFKBRAIMPAGZRZ-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

240.2
MW (Da)
0.77
ALogP
5
HBA
3
HBD
113.5
PSA (Ų)
0.39
QED
0
Ro5 Violations
1
Rot. Bonds

Drug Information

Molecule Type Unknown
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C9H8N2O4S
MW 240.24
Aromatic Rings 2
Heavy Atoms 16
NP-Likeness -0.46

Data from ChEMBL 36 via Core Engine