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Compound Detail

CHEMBL101823

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O=C1c2nc3ccccc3c(-c3ccccc3)c2CN1Cc1ccccc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL101823
Phase Preclinical
Structure Type MOL
InChI Key IIOMKAGPYJPVNS-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
2
Publications
0
Known Names

Molecular Properties

350.4
MW (Da)
5.06
ALogP
2
HBA
0
HBD
33.2
PSA (Ų)
0.52
QED
1
Ro5 Violations
3
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C24H18N2O
MW 350.42
Aromatic Rings 4
Heavy Atoms 27
NP-Likeness -0.42

Literature References

PubMed DOI Target Context # Activities
9288173 10.1021/jm960516m Translocator protein 1
34254805 10.1021/acs.jmedchem.1c00379 Translocator protein 1

Data from ChEMBL 36 via Core Engine