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Compound Detail

CHEMBL4800052

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O=C(c1ccc(F)c(NS(=O)(=O)Cc2ccccc2)c1F)c1n[nH]c2ncc(-c3ccc(O)cc3)cc12
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL4800052
Phase Preclinical
Structure Type MOL
InChI Key JNWAEUIYQMTGME-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

520.5
MW (Da)
4.78
ALogP
6
HBA
3
HBD
125.0
PSA (Ų)
0.27
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 C26H18F2N4O4S
MW 520.52
Aromatic Rings 5
Heavy Atoms 37
NP-Likeness -1.18

Data from ChEMBL 36 via Core Engine