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Compound Detail

CHEMBL6027505

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CCOc1c(C(C)n2nc(C)c3c(N)ncnc32)cc(Cl)c(C#N)c1C1CN(C(C)(C)C(=O)N(C)C)C1

Basic Information

ChEMBL ID CHEMBL6027505
Phase Preclinical
Structure Type MOL
InChI Key NENSZFPDCTVZCA-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

525.1
MW (Da)
3.52
ALogP
9
HBA
1
HBD
126.2
PSA (Ų)
0.50
QED
1
Ro5 Violations
7
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C26H33ClN8O2
MW 525.06
Aromatic Rings 3
Heavy Atoms 37
NP-Likeness -0.95

Data from ChEMBL 36 via Core Engine