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Compound Detail

CHEMBL16160

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CCCc1cc(OC)c(O)c(C(=O)NCC2CCCN2CC)c1OC
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL16160
Phase Preclinical
Structure Type MOL
InChI Key DLPRWZRVRSUBEK-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

350.5
MW (Da)
2.58
ALogP
5
HBA
2
HBD
71.0
PSA (Ų)
0.75
QED
0
Ro5 Violations
8
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C19H30N2O4
MW 350.46
Aromatic Rings 1
Heavy Atoms 25
NP-Likeness -0.14

Literature References

PubMed DOI Target Context # Activities
1969484 10.1021/jm00166a012 D(2) dopamine receptor 1

Data from ChEMBL 36 via Core Engine