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Compound Detail

CHEMBL1623159

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Cc1ccc2[nH]c(C)c(/C=C/c3cc[n+](C)cc3)c2c1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1623159
Phase Preclinical
Structure Type MOL
InChI Key HSODZLKRNDIKEN-UHFFFAOYSA-O
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

263.4
MW (Da)
3.78
ALogP
0
HBA
1
HBD
19.7
PSA (Ų)
0.68
QED
0
Ro5 Violations
2
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C18H19N2+
MW 263.36
Aromatic Rings 3
Heavy Atoms 20
NP-Likeness -0.17

Data from ChEMBL 36 via Core Engine