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Compound Detail

CHEMBL1195621

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CN(C)CCSc1nc2ccccc2cc1-c1ccccc1Cl
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1195621
Phase Preclinical
Structure Type MOL
InChI Key XTUMSQUISUXLLL-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

342.9
MW (Da)
5.21
ALogP
3
HBA
0
HBD
16.1
PSA (Ų)
0.59
QED
1
Ro5 Violations
5
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C19H19ClN2S
MW 342.90
Aromatic Rings 3
Heavy Atoms 23
NP-Likeness -1.33

Data from ChEMBL 36 via Core Engine