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Compound Detail

CHEMBL1622026

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CC(Oc1ccccc1)C(=O)NC1C(=O)N2C1SC(C)(C)C2C(=O)O
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1622026
Phase Preclinical
Structure Type MOL
InChI Key NONJJLVGHLVQQM-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

364.4
MW (Da)
1.09
ALogP
5
HBA
2
HBD
95.9
PSA (Ų)
0.76
QED
0
Ro5 Violations
5
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

Natural Product First in Class Prodrug

Extended Properties

Molecular Formula C17H20N2O5S
MW 364.42
Aromatic Rings 1
Heavy Atoms 25
NP-Likeness 0.11

Data from ChEMBL 36 via Core Engine