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Compound Detail

CHEMBL1178288

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CCNC(=O)NC(=O)C[n+]1ccc(/C=C/c2cccc3ccccc23)cc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1178288
Phase Preclinical
Structure Type MOL
InChI Key GEFNIAOKXZMGQT-ZHACJKMWSA-O
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

360.4
MW (Da)
3.14
ALogP
2
HBA
2
HBD
62.1
PSA (Ų)
0.69
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 C22H22N3O2+
MW 360.44
Aromatic Rings 3
Heavy Atoms 27
NP-Likeness -0.98

Data from ChEMBL 36 via Core Engine