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Compound Detail

CHEMBL4595675

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Nc1ncc(-c2cccc3c2ccn3S(=O)(=O)c2ccccc2)[nH]1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL4595675
Phase Preclinical
Structure Type MOL
InChI Key NSVORFHVEAPMBK-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

338.4
MW (Da)
2.85
ALogP
5
HBA
2
HBD
93.8
PSA (Ų)
0.60
QED
0
Ro5 Violations
3
Rot. Bonds

Drug Information

Molecule Type Unknown
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C17H14N4O2S
MW 338.39
Aromatic Rings 4
Heavy Atoms 24
NP-Likeness -0.88

Data from ChEMBL 36 via Core Engine