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Compound Detail

CHEMBL2004532

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O=C(Nc1ccc2c(c1)C(=O)NC2=O)c1nc2ccccc2s1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL2004532
Phase Preclinical
Structure Type MOL
InChI Key MIXXBFHGLIDTOW-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

323.3
MW (Da)
2.43
ALogP
5
HBA
2
HBD
88.2
PSA (Ų)
0.71
QED
0
Ro5 Violations
2
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C16H9N3O3S
MW 323.33
Aromatic Rings 3
Heavy Atoms 23
NP-Likeness -1.80

Data from ChEMBL 36 via Core Engine