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Compound Detail

CHEMBL1179449

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C[n+]1cc2[nH]c3ccccc3c2c2[nH]c3ccccc3c21
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1179449
Phase Preclinical
Structure Type MOL
InChI Key WFCKBBCTSSIZCQ-UHFFFAOYSA-O
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

272.3
MW (Da)
3.78
ALogP
0
HBA
2
HBD
35.5
PSA (Ų)
0.40
QED
0
Ro5 Violations
0
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C18H14N3+
MW 272.33
Aromatic Rings 5
Heavy Atoms 21
NP-Likeness 0.78

Data from ChEMBL 36 via Core Engine