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Compound Detail

CHEMBL1197593

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CCOc1ccc2nc(C)cc(Nc3ccc(N(C)C)cc3)c2c1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1197593
Phase Preclinical
Structure Type MOL
InChI Key KDWYQXRDCTWRIT-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

321.4
MW (Da)
4.75
ALogP
4
HBA
1
HBD
37.4
PSA (Ų)
0.74
QED
0
Ro5 Violations
5
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C20H23N3O
MW 321.42
Aromatic Rings 3
Heavy Atoms 24
NP-Likeness -1.46

Data from ChEMBL 36 via Core Engine