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Compound Detail

CHEMBL1183100

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

Basic Information

ChEMBL ID CHEMBL1183100
Phase Preclinical
Structure Type MOL
InChI Key WOCXTQOOZVZSCS-ZHACJKMWSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

260.4
MW (Da)
4.32
ALogP
0
HBA
0
HBD
3.9
PSA (Ų)
0.62
QED
0
Ro5 Violations
3
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C19H18N+
MW 260.36
Aromatic Rings 3
Heavy Atoms 20
NP-Likeness -0.20

Data from ChEMBL 36 via Core Engine