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Compound Detail

CHEMBL426481

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Cc1cc(N(C)CCN(C)C)nc2ccc(NC(=O)C3CC3c3ccccc3)cc12
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL426481
Phase Preclinical
Structure Type MOL
InChI Key KJGBRJCGHINNNU-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

402.5
MW (Da)
4.28
ALogP
4
HBA
1
HBD
48.5
PSA (Ų)
0.64
QED
0
Ro5 Violations
7
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C25H30N4O
MW 402.54
Aromatic Rings 3
Heavy Atoms 30
NP-Likeness -1.39

Literature References

PubMed DOI Target Context # Activities
16289819 10.1016/j.bmcl.2005.10.066 Melanin-concentrating hormone receptor 1 1

Data from ChEMBL 36 via Core Engine