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Compound Detail

CHEMBL1599090

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COC(=O)c1sccc1NC(=O)Nc1ccc(C)cc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1599090
Phase Preclinical
Structure Type MOL
InChI Key VYZMZHMPNLZWIW-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

290.3
MW (Da)
3.49
ALogP
4
HBA
2
HBD
67.4
PSA (Ų)
0.85
QED
0
Ro5 Violations
3
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C14H14N2O3S
MW 290.34
Aromatic Rings 2
Heavy Atoms 20
NP-Likeness -2.04

Data from ChEMBL 36 via Core Engine