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Compound Detail

CHEMBL1467369

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Cc1ccc(NC(=O)COC(=O)/C(=C/c2cccs2)c2cccs2)cc1S(=O)(=O)N(C)C
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1467369
Phase Preclinical
Structure Type MOL
InChI Key HMEVYODEGHPDDI-QGOAFFKASA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

490.6
MW (Da)
4.09
ALogP
7
HBA
1
HBD
92.8
PSA (Ų)
0.38
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 C22H22N2O5S3
MW 490.63
Aromatic Rings 3
Heavy Atoms 32
NP-Likeness -2.21

Data from ChEMBL 36 via Core Engine