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Compound Detail

CHEMBL1378427

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Cc1ccc(O)c(N=Cc2cccs2)c1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1378427
Phase Preclinical
Structure Type MOL
InChI Key NLJMPZLJRDIZQW-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

217.3
MW (Da)
3.51
ALogP
3
HBA
1
HBD
32.6
PSA (Ų)
0.77
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 C12H11NOS
MW 217.29
Aromatic Rings 2
Heavy Atoms 15
NP-Likeness -1.78

Data from ChEMBL 36 via Core Engine