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Compound Detail

CHEMBL1207741

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CC1=C(C(=O)O)N2C(=O)/C(=C/c3ccccn3)[C@H]2S(=O)(=O)C1C
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1207741
Phase Preclinical
Structure Type MOL
InChI Key GMTDEGHLQBWALG-WNRROLJZSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

334.4
MW (Da)
0.81
ALogP
5
HBA
1
HBD
104.6
PSA (Ų)
0.63
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 C15H14N2O5S
MW 334.35
Aromatic Rings 1
Heavy Atoms 23
NP-Likeness -0.39

Data from ChEMBL 36 via Core Engine