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Compound Detail

CHEMBL1164896

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CC(C)(C)OC(=O)NCCCCCCn1ccc(=O)c2c1ncn2Cc1ccccc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1164896
Phase Preclinical
Structure Type MOL
InChI Key CGMXFTWOGYGROV-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

424.6
MW (Da)
4.33
ALogP
6
HBA
1
HBD
78.2
PSA (Ų)
0.52
QED
0
Ro5 Violations
9
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C24H32N4O3
MW 424.55
Aromatic Rings 3
Heavy Atoms 31
NP-Likeness -1.00

Literature References

PubMed DOI Target Context # Activities
20207054 10.1016/j.ejmech.2010.02.033 Unchecked 2

Data from ChEMBL 36 via Core Engine