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Compound Detail

CHEMBL334239

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CCCN(CCC)c1cc(C)nc2c(-c3ccc(OCCN(C)C)cc3)c(C)nn12

Basic Information

ChEMBL ID CHEMBL334239
Phase Preclinical
Structure Type MOL
InChI Key FBSSOZPVRIFCKC-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
2
Publications
0
Known Names

Molecular Properties

409.6
MW (Da)
4.58
ALogP
6
HBA
0
HBD
45.9
PSA (Ų)
0.49
QED
0
Ro5 Violations
10
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C24H35N5O
MW 409.58
Aromatic Rings 3
Heavy Atoms 30
NP-Likeness -1.32

Literature References

PubMed DOI Target Context # Activities
15203140 10.1016/j.bmcl.2004.05.019 Corticotropin-releasing factor receptor 1 1
15203140 10.1016/j.bmcl.2004.05.019 No relevant target 1

Data from ChEMBL 36 via Core Engine