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Compound Detail

CHEMBL1182746

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N=C(N)NC(=O)c1cc2c(-c3cc(F)cc(F)c3)cccc2s1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1182746
Phase Preclinical
Structure Type MOL
InChI Key FIAANMFVGOHIRY-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

331.4
MW (Da)
3.47
ALogP
3
HBA
3
HBD
79.0
PSA (Ų)
0.50
QED
0
Ro5 Violations
2
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C16H11F2N3OS
MW 331.35
Aromatic Rings 3
Heavy Atoms 23
NP-Likeness -1.30

Data from ChEMBL 36 via Core Engine