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Compound Detail

CHEMBL5498627

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Cc1nn(C)c2c1CSCc1cc(n(C)n1)CCc1cc(c3ccc(F)cc3c1)OCCCc1c(C(=O)O)n(C)c3c-2c(Cl)ccc13
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL5498627
Phase Preclinical
Structure Type MOL
InChI Key GGJGJSHRCGGOPW-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

672.2
MW (Da)
7.81
ALogP
8
HBA
1
HBD
87.1
PSA (Ų)
0.19
QED
2
Ro5 Violations
1
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C36H35ClFN5O3S
MW 672.23
Aromatic Rings 6
Heavy Atoms 47
NP-Likeness -0.32

Data from ChEMBL 36 via Core Engine