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Compound Detail

CHEMBL1206275

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O=C(O)c1csc(-n2cc(CC(F)(F)F)c3ccc(Cl)cc32)n1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1206275
Phase Preclinical
Structure Type MOL
InChI Key OHCABHSQBRACBW-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

360.7
MW (Da)
4.54
ALogP
4
HBA
1
HBD
55.1
PSA (Ų)
0.75
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 C14H8ClF3N2O2S
MW 360.74
Aromatic Rings 3
Heavy Atoms 23
NP-Likeness -1.29

Data from ChEMBL 36 via Core Engine