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Compound Detail

CHEMBL1206389

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CC(=O)OCC1=C(C(=O)O)N2C(=O)/C(=C/c3ccccc3)[C@H]2S(=O)(=O)C1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1206389
Phase Preclinical
Structure Type MOL
InChI Key YOCVKSISBJBEES-VXXVJXPCSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

377.4
MW (Da)
0.57
ALogP
6
HBA
1
HBD
118.0
PSA (Ų)
0.46
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 C17H15NO7S
MW 377.37
Aromatic Rings 1
Heavy Atoms 26
NP-Likeness 0.22

Data from ChEMBL 36 via Core Engine