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Compound Detail

CHEMBL1179457

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CC(C)CCCOc1nsnc1C1=CCCN(C)C1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1179457
Phase Preclinical
Structure Type MOL
InChI Key BBFYFLUXOWMIDL-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

281.4
MW (Da)
3.07
ALogP
5
HBA
0
HBD
38.2
PSA (Ų)
0.75
QED
0
Ro5 Violations
6
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C14H23N3OS
MW 281.43
Aromatic Rings 1
Heavy Atoms 19
NP-Likeness -0.37

Data from ChEMBL 36 via Core Engine