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Compound Detail

CHEMBL4435260

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O=C(Nc1cccc2[nH]ccc12)c1ccc2ccccc2c1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL4435260
Phase Preclinical
Structure Type MOL
InChI Key HFIDQBVGOBGMCT-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

286.3
MW (Da)
4.57
ALogP
1
HBA
2
HBD
44.9
PSA (Ų)
0.56
QED
0
Ro5 Violations
2
Rot. Bonds

Drug Information

Molecule Type Unknown
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C19H14N2O
MW 286.33
Aromatic Rings 4
Heavy Atoms 22
NP-Likeness -1.02

Literature References

PubMed DOI Target Context # Activities
32142284 10.1021/acs.jmedchem.9b01979 Deoxyhypusine synthase 1

Data from ChEMBL 36 via Core Engine