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Compound Detail

CHEMBL3728855

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Cn1nc(-c2ccccc2)cc1-c1ccc(C(=O)Nc2c(F)cccc2F)s1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL3728855
Phase Preclinical
Structure Type MOL
InChI Key SBXZSRFONFSDQE-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

395.4
MW (Da)
5.35
ALogP
4
HBA
1
HBD
46.9
PSA (Ų)
0.51
QED
1
Ro5 Violations
4
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C21H15F2N3OS
MW 395.43
Aromatic Rings 4
Heavy Atoms 28
NP-Likeness -1.74

Data from ChEMBL 36 via Core Engine