Skip to main content
Free research Free research Free compound review with research home and workspace preview
Quick search ChEMBL 36
Compound Detail

CHEMBL130605

Enter ChEMBL ID:
Free Research Context This compound will appear in recent viewed items on the research home for this browser.
Research home View demo workspace
C1=CCN(CCCCc2c[nH]c3ccccc23)CC1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL130605
Phase Preclinical
Structure Type MOL
InChI Key RNGZXDOUGRHLBQ-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
2
Publications
0
Known Names

Molecular Properties

254.4
MW (Da)
3.75
ALogP
1
HBA
1
HBD
19.0
PSA (Ų)
0.64
QED
0
Ro5 Violations
5
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C17H22N2
MW 254.38
Aromatic Rings 2
Heavy Atoms 19
NP-Likeness -0.21

Literature References

PubMed DOI Target Context # Activities
1359142 10.1021/jm00100a006 D(2) dopamine receptor 2
1359142 10.1021/jm00100a006 Rattus norvegicus 1

Data from ChEMBL 36 via Core Engine