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Compound Detail

CHEMBL3325919

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CN1CCc2cc(N)ccc2C(c2ccccc2)C1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL3325919
Phase Preclinical
Structure Type MOL
InChI Key GZCUMTDIYBMHMP-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
3
Publications
0
Known Names

Molecular Properties

252.4
MW (Da)
2.89
ALogP
2
HBA
1
HBD
29.3
PSA (Ų)
0.79
QED
0
Ro5 Violations
1
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C17H20N2
MW 252.36
Aromatic Rings 2
Heavy Atoms 19
NP-Likeness -0.07

Literature References

PubMed DOI Target Context # Activities
25076379 10.1016/j.ejmech.2014.07.059 D(1A) dopamine receptor 1
25076379 10.1016/j.ejmech.2014.07.059 D(2) dopamine receptor 1
25076379 10.1016/j.ejmech.2014.07.059 D(3) dopamine receptor 1

Data from ChEMBL 36 via Core Engine