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Compound Detail

CHEMBL3732677

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Cn1nc(C(F)(F)F)cc1-c1sc(C(=O)Nc2ccccc2F)cc1N
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL3732677
Phase Preclinical
Structure Type MOL
InChI Key HRRGZRVYQOLKBI-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

384.4
MW (Da)
4.14
ALogP
5
HBA
2
HBD
72.9
PSA (Ų)
0.67
QED
0
Ro5 Violations
3
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C16H12F4N4OS
MW 384.36
Aromatic Rings 3
Heavy Atoms 26
NP-Likeness -1.94

Data from ChEMBL 36 via Core Engine