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Compound Detail

CHEMBL1530910

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COc1cccc(CNC(=O)CCNS(=O)(=O)c2cccc3nsnc23)c1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1530910
Phase Preclinical
Structure Type MOL
InChI Key MYNYSUZMBWCWCT-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

406.5
MW (Da)
1.68
ALogP
7
HBA
2
HBD
110.3
PSA (Ų)
0.59
QED
0
Ro5 Violations
8
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C17H18N4O4S2
MW 406.49
Aromatic Rings 3
Heavy Atoms 27
NP-Likeness -2.13

Data from ChEMBL 36 via Core Engine