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Compound Detail

CHEMBL5221692

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CC(C)Oc1ccc(-c2cn(-c3ccc(CN4CC(C(=O)O)C4)cc3)nn2)cc1C#N
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL5221692
Phase Preclinical
Structure Type MOL
InChI Key ZEWMKGVNRBCYIO-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

417.5
MW (Da)
3.11
ALogP
7
HBA
1
HBD
104.3
PSA (Ų)
0.63
QED
0
Ro5 Violations
7
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C23H23N5O3
MW 417.47
Aromatic Rings 3
Heavy Atoms 31
NP-Likeness -1.73

Data from ChEMBL 36 via Core Engine