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Compound Detail

CHEMBL169599

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c1csc(Cc2c[nH]cn2)c1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL169599
Phase Preclinical
Structure Type MOL
InChI Key WJTRJFZWODRGDQ-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

164.2
MW (Da)
2.06
ALogP
2
HBA
1
HBD
28.7
PSA (Ų)
0.72
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 C8H8N2S
MW 164.23
Aromatic Rings 2
Heavy Atoms 11
NP-Likeness -1.79

Data from ChEMBL 36 via Core Engine