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Compound Detail

CHEMBL5315673

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CCCn1c2cc(OCCC(C)C)ccc2c2cc[n+](Cc3ccccn3)c(C)c21
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL5315673
Phase Preclinical
Structure Type MOL
InChI Key DASJPGCABASBAV-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

402.6
MW (Da)
5.67
ALogP
3
HBA
0
HBD
30.9
PSA (Ų)
0.36
QED
1
Ro5 Violations
8
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C26H32N3O+
MW 402.56
Aromatic Rings 4
Heavy Atoms 30
NP-Likeness -0.55

Data from ChEMBL 36 via Core Engine