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Compound Detail

CHEMBL5758424

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COc1c(C(C)n2nc(C)c3c(N)ncnc32)cc(Cl)c(C)c1C1CN(C)C1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL5758424
Phase Preclinical
Structure Type MOL
InChI Key BVISSWCHEUOQLQ-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

400.9
MW (Da)
3.33
ALogP
7
HBA
1
HBD
82.1
PSA (Ų)
0.72
QED
0
Ro5 Violations
4
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C20H25ClN6O
MW 400.91
Aromatic Rings 3
Heavy Atoms 28
NP-Likeness -0.57

Data from ChEMBL 36 via Core Engine