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Compound Detail

CHEMBL5816449

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Nc1ccccc1NC(=O)/C=C/c1cnn(CCOc2ccccc2)c1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL5816449
Phase Preclinical
Structure Type MOL
InChI Key DRTRFTUUTGJAMS-ZHACJKMWSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

348.4
MW (Da)
3.20
ALogP
5
HBA
2
HBD
82.2
PSA (Ų)
0.51
QED
0
Ro5 Violations
7
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C20H20N4O2
MW 348.41
Aromatic Rings 3
Heavy Atoms 26
NP-Likeness -1.48

Data from ChEMBL 36 via Core Engine