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Compound Detail

CHEMBL1370388

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CSc1nc(-c2ccccc2)nc(-c2ccccc2)n1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1370388
Phase Preclinical
Structure Type MOL
InChI Key KZTKYEIHHXCHCS-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

279.4
MW (Da)
3.93
ALogP
4
HBA
0
HBD
38.7
PSA (Ų)
0.68
QED
0
Ro5 Violations
3
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C16H13N3S
MW 279.37
Aromatic Rings 3
Heavy Atoms 20
NP-Likeness -1.05

Data from ChEMBL 36 via Core Engine