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Compound Detail

CHEMBL3360934

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O=c1c2cn(Cc3ccccc3)c3ccccc3c-2nn1Cc1ccccn1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL3360934
Phase Preclinical
Structure Type MOL
InChI Key HKIOJYJKRFXZET-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

366.4
MW (Da)
3.79
ALogP
5
HBA
0
HBD
52.7
PSA (Ų)
0.49
QED
0
Ro5 Violations
4
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C23H18N4O
MW 366.42
Aromatic Rings 3
Heavy Atoms 28
NP-Likeness -1.63

Literature References

PubMed DOI Target Context # Activities
25435150 10.1016/j.bmcl.2014.11.011 Muscarinic acetylcholine receptor M1 3

Data from ChEMBL 36 via Core Engine