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Compound Detail

CHEMBL195928

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CCN(C)CCc1cnccc1N
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL195928
Phase Preclinical
Structure Type MOL
InChI Key TULVRYOLTKEOHL-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

179.3
MW (Da)
1.16
ALogP
3
HBA
1
HBD
42.1
PSA (Ų)
0.75
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 C10H17N3
MW 179.27
Aromatic Rings 1
Heavy Atoms 13
NP-Likeness -1.16

Literature References

PubMed DOI Target Context # Activities
16039854 10.1016/j.bmcl.2005.06.053 Neuronal acetylcholine receptor; alpha4/beta2 1

Data from ChEMBL 36 via Core Engine