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Compound Detail

CHEMBL6069133

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C#CCCCSc1cc(OC)c(CCN)cc1OC
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL6069133
Phase Preclinical
Structure Type MOL
InChI Key XATVMRGATSLJMP-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

279.4
MW (Da)
2.71
ALogP
4
HBA
1
HBD
44.5
PSA (Ų)
0.45
QED
0
Ro5 Violations
8
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C15H21NO2S
MW 279.40
Aromatic Rings 1
Heavy Atoms 19
NP-Likeness -0.38

Data from ChEMBL 36 via Core Engine