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Compound Detail

CHEMBL142786

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CC(C)c1ccc2nc3ccc(CCCCCCc4cccnc4)cn3c(=O)c2c1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL142786
Phase Preclinical
Structure Type MOL
InChI Key XSAMKGLQFRFRTF-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

399.5
MW (Da)
5.71
ALogP
4
HBA
0
HBD
47.3
PSA (Ų)
0.28
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 C26H29N3O
MW 399.54
Aromatic Rings 4
Heavy Atoms 30
NP-Likeness -0.87

Literature References

PubMed DOI Target Context # Activities
3339617 10.1021/jm00397a034 Platelet-activating factor receptor 2

Data from ChEMBL 36 via Core Engine