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Compound Detail

CHEMBL340324

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CN(C)CCCC1CN(C)CCc2cc(Cl)c(O)cc21
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL340324
Phase Preclinical
Structure Type MOL
InChI Key TZWBHWCSLLOIOT-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
3
Publications
0
Known Names

Molecular Properties

296.8
MW (Da)
2.96
ALogP
3
HBA
1
HBD
26.7
PSA (Ų)
0.93
QED
0
Ro5 Violations
4
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C16H25ClN2O
MW 296.84
Aromatic Rings 1
Heavy Atoms 20
NP-Likeness -0.10

Literature References

PubMed DOI Target Context # Activities
- 10.1016/S0960-894X(00)80155-9 D(1A) dopamine receptor 1
- 10.1016/S0960-894X(00)80155-9 D(2) dopamine receptor 1
- 10.1016/S0960-894X(00)80155-9 Rattus norvegicus 1

Data from ChEMBL 36 via Core Engine