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Compound Detail

CHEMBL1731264

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Cc1ccc(N/C=C(\C#N)S(=O)(=O)c2ccccc2)cc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1731264
Phase Preclinical
Structure Type MOL
InChI Key KGWNDNYWWSDMQJ-FOWTUZBSSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

298.4
MW (Da)
3.25
ALogP
4
HBA
1
HBD
70.0
PSA (Ų)
0.88
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 C16H14N2O2S
MW 298.37
Aromatic Rings 2
Heavy Atoms 21
NP-Likeness -1.58

Data from ChEMBL 36 via Core Engine