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Compound Detail

CHEMBL1620662

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CCCCCCCCCCOC[n+]1cn(Cc2ccccc2)c2ccccc21
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1620662
Phase Preclinical
Structure Type MOL
InChI Key STZOUNYUCWCNBI-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

379.6
MW (Da)
6.09
ALogP
2
HBA
0
HBD
18.0
PSA (Ų)
0.26
QED
1
Ro5 Violations
13
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C25H35N2O+
MW 379.57
Aromatic Rings 3
Heavy Atoms 28
NP-Likeness -0.20

Data from ChEMBL 36 via Core Engine