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Compound Detail

CHEMBL4561494

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Cc1ccc(-c2csc(Cn3nc(CC(=O)NS(C)(=O)=O)c4ccccc4c3=O)n2)cc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL4561494
Phase Preclinical
Structure Type MOL
InChI Key VPMAGILRVBXZJD-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

468.6
MW (Da)
2.50
ALogP
8
HBA
1
HBD
111.0
PSA (Ų)
0.47
QED
0
Ro5 Violations
6
Rot. Bonds

Drug Information

Molecule Type Unknown
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C22H20N4O4S2
MW 468.56
Aromatic Rings 4
Heavy Atoms 32
NP-Likeness -1.79

Data from ChEMBL 36 via Core Engine