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Compound Detail

CHEMBL1528874

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Cn1c(-c2ccccc2)cnc1SCc1nc(O)c2ccccc2n1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1528874
Phase Preclinical
Structure Type MOL
InChI Key OYJMHBWMRQYJDV-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

348.4
MW (Da)
4.03
ALogP
6
HBA
1
HBD
63.8
PSA (Ų)
0.56
QED
0
Ro5 Violations
4
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C19H16N4OS
MW 348.43
Aromatic Rings 4
Heavy Atoms 25
NP-Likeness -1.76

Data from ChEMBL 36 via Core Engine