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Compound Detail

CHEMBL2219833

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Cc1c2c(cc[n+]1CCc1ccccc1)c1ccc(OCc3ccccc3)cc1n2Cc1ccccc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL2219833
Phase Preclinical
Structure Type MOL
InChI Key KWROMTSAUFYLRW-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

483.6
MW (Da)
7.26
ALogP
2
HBA
0
HBD
18.0
PSA (Ų)
0.21
QED
1
Ro5 Violations
8
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C34H31N2O+
MW 483.64
Aromatic Rings 6
Heavy Atoms 37
NP-Likeness -0.15

Data from ChEMBL 36 via Core Engine