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Compound Detail

CHEMBL4070465

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CC1=CC(=O)C(=O)c2c(-c3ccccc3)cn(S(=O)(=O)c3ccccc3)c21
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL4070465
Phase Preclinical
Structure Type MOL
InChI Key PGNULCSNSPVKAD-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

377.4
MW (Da)
3.56
ALogP
5
HBA
0
HBD
73.2
PSA (Ų)
0.65
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 C21H15NO4S
MW 377.42
Aromatic Rings 3
Heavy Atoms 27
NP-Likeness -0.15

Literature References

PubMed DOI Target Context # Activities
29313684 10.1021/acs.jmedchem.7b01176 ELAV-like protein 1 1

Data from ChEMBL 36 via Core Engine