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Compound Detail

CHEMBL1886655

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Cc1ccc2nc(NC(=O)c3cccc(-n4cnnn4)c3)sc2c1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1886655
Phase Preclinical
Structure Type MOL
InChI Key SRPUYBSXJLLNNQ-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

336.4
MW (Da)
2.83
ALogP
7
HBA
1
HBD
85.6
PSA (Ų)
0.62
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 C16H12N6OS
MW 336.38
Aromatic Rings 4
Heavy Atoms 24
NP-Likeness -3.41

Data from ChEMBL 36 via Core Engine