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Compound Detail

CHEMBL1529804

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c1ccc(CSCCc2ccncc2)cc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1529804
Phase Preclinical
Structure Type MOL
InChI Key PNKGCTZQQQGNKN-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

229.3
MW (Da)
3.56
ALogP
2
HBA
0
HBD
12.9
PSA (Ų)
0.73
QED
0
Ro5 Violations
5
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C14H15NS
MW 229.35
Aromatic Rings 2
Heavy Atoms 16
NP-Likeness -1.19

Data from ChEMBL 36 via Core Engine