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Compound Detail

CHEMBL4162053

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CCOC(=O)c1nc2ccccc2nc1Nc1ccc(C2CCN(C)CC2)cc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL4162053
Phase Preclinical
Structure Type MOL
InChI Key BSBCKQZFNBTCLT-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

390.5
MW (Da)
4.36
ALogP
6
HBA
1
HBD
67.3
PSA (Ų)
0.65
QED
0
Ro5 Violations
5
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C23H26N4O2
MW 390.49
Aromatic Rings 3
Heavy Atoms 29
NP-Likeness -0.95

Literature References

PubMed DOI Target Context # Activities
29778892 10.1016/j.ejmech.2018.04.056 Serine/threonine-protein kinase pim-1 1

Data from ChEMBL 36 via Core Engine