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Compound Detail

CHEMBL1179662

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COc1ccc(N(C)c2nc(Nc3ccccc3C)[n+](C)c3ccccc23)cc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1179662
Phase Preclinical
Structure Type MOL
InChI Key QZTIRVRSXPADLI-UHFFFAOYSA-O
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

385.5
MW (Da)
4.89
ALogP
4
HBA
1
HBD
41.3
PSA (Ų)
0.50
QED
0
Ro5 Violations
5
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C24H25N4O+
MW 385.49
Aromatic Rings 4
Heavy Atoms 29
NP-Likeness -0.72

Data from ChEMBL 36 via Core Engine