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Compound Detail

CHEMBL5221431

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NC1CCN(C(=O)CO/N=C2C(=C3/C(=O)Nc4ccc(Cl)cc43)/Nc3ccccc3/2)CC1

Basic Information

ChEMBL ID CHEMBL5221431
Phase Preclinical
Structure Type MOL
InChI Key DEQPJCBQCVSYEK-NXGRKYSHSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

451.9
MW (Da)
2.80
ALogP
6
HBA
3
HBD
109.0
PSA (Ų)
0.49
QED
0
Ro5 Violations
3
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C23H22ClN5O3
MW 451.91
Aromatic Rings 2
Heavy Atoms 32
NP-Likeness -0.70

Data from ChEMBL 36 via Core Engine