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Compound Detail

CHEMBL509839

ISODICTAMNINE
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Cn1c2ccccc2c(=O)c2ccoc21
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL509839
Name ISODICTAMNINE
Phase Preclinical
Structure Type MOL
InChI Key FUVCJKNEOUWLPI-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
3
Publications
0
Known Names

Molecular Properties

199.2
MW (Da)
2.28
ALogP
3
HBA
0
HBD
35.1
PSA (Ų)
0.56
QED
0
Ro5 Violations
0
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

Natural Product First in Class Prodrug

Extended Properties

Molecular Formula C12H9NO2
MW 199.21
Aromatic Rings 3
Heavy Atoms 15
NP-Likeness 0.78

Literature References

PubMed DOI Target Context # Activities
15387647 10.1021/np0400611 Unchecked 4
15387647 10.1021/np0400611 Raji 4
18211005 10.1021/np070594k NON-PROTEIN TARGET 2

Data from ChEMBL 36 via Core Engine