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Compound Detail

CHEMBL3040221

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CO/N=C(\N)c1ccc(-c2cccc(-c3ccc(/C(N)=N\OC)cn3)c2)nc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL3040221
Phase Preclinical
Structure Type MOL
InChI Key APAMRROWEQXTFJ-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

376.4
MW (Da)
2.34
ALogP
6
HBA
2
HBD
121.0
PSA (Ų)
0.39
QED
0
Ro5 Violations
6
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C20H20N6O2
MW 376.42
Aromatic Rings 3
Heavy Atoms 28
NP-Likeness -0.75

Data from ChEMBL 36 via Core Engine