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Compound Detail

CHEMBL1711872

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Cc1ccccc1S(=O)(=O)n1c(N)nc2ccccc21
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1711872
Phase Preclinical
Structure Type MOL
InChI Key HCRJQMZWSFKNPD-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

287.3
MW (Da)
2.16
ALogP
5
HBA
1
HBD
78.0
PSA (Ų)
0.78
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 C14H13N3O2S
MW 287.34
Aromatic Rings 3
Heavy Atoms 20
NP-Likeness -1.40

Data from ChEMBL 36 via Core Engine