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Compound Detail

CHEMBL3304537

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CCOc1ccc(/N=C2/NCC(c3ccco3)N2)cc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL3304537
Phase Preclinical
Structure Type MOL
InChI Key LSLXRMXPOVJKHW-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

271.3
MW (Da)
2.60
ALogP
3
HBA
2
HBD
58.8
PSA (Ų)
0.90
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 C15H17N3O2
MW 271.32
Aromatic Rings 2
Heavy Atoms 20
NP-Likeness -0.72

Data from ChEMBL 36 via Core Engine