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Compound Detail

CHEMBL1621499

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CCN(CC)c1ccc2nc3ccc(N)cc3[n+](-c3ccccc3)c2c1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1621499
Phase Preclinical
Structure Type MOL
InChI Key GVXANNXCNJZRKF-UHFFFAOYSA-O
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

343.4
MW (Da)
4.09
ALogP
3
HBA
1
HBD
46.0
PSA (Ų)
0.34
QED
0
Ro5 Violations
4
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C22H23N4+
MW 343.45
Aromatic Rings 4
Heavy Atoms 26
NP-Likeness -0.77

Data from ChEMBL 36 via Core Engine