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Compound Detail

CHEMBL4561556

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Cc1ccc(C)n1-c1cc(C(=O)N2CCCC(c3ccc(C(=O)NS(C)(=O)=O)cc3)C2)ccc1C(=O)NS(C)(=O)=O
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL4561556
Phase Preclinical
Structure Type MOL
InChI Key DQJWWSVROPCQKF-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

600.7
MW (Da)
2.49
ALogP
8
HBA
2
HBD
151.7
PSA (Ų)
0.42
QED
1
Ro5 Violations
7
Rot. Bonds

Drug Information

Molecule Type Unknown
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C28H32N4O7S2
MW 600.72
Aromatic Rings 3
Heavy Atoms 41
NP-Likeness -1.03

Data from ChEMBL 36 via Core Engine