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Compound Detail

CHEMBL4803095

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N[C@H]1CC[C@H](Nc2ncnc3c(C(=O)Nc4c(Cl)ccc(NS(=O)(=O)Cc5ccccc5)c4F)csc23)CC1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL4803095
Phase Preclinical
Structure Type MOL
InChI Key WWMSCDVLVDWOBQ-QAQDUYKDSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

589.1
MW (Da)
5.36
ALogP
8
HBA
4
HBD
139.1
PSA (Ų)
0.22
QED
2
Ro5 Violations
8
Rot. Bonds

Drug Information

Molecule Type Unknown
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C26H26ClFN6O3S2
MW 589.12
Aromatic Rings 4
Heavy Atoms 39
NP-Likeness -1.69

Data from ChEMBL 36 via Core Engine