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Compound Detail

CHEMBL1789431

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CC[N+](CC)=c1ccc2nc3c(ccc4ccccc43)oc-2c1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1789431
Phase Preclinical
Structure Type MOL
InChI Key IXYMKBMHKIJBCD-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

303.4
MW (Da)
3.90
ALogP
2
HBA
0
HBD
29.0
PSA (Ų)
0.32
QED
0
Ro5 Violations
2
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C20H19N2O+
MW 303.39
Aromatic Rings 2
Heavy Atoms 23
NP-Likeness -0.48

Data from ChEMBL 36 via Core Engine