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Compound Detail

CHEMBL2393232

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CCNc1nc(N2CCN(C)CC2)nc2c1CCNCC2.Cl
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL2393232
Phase Preclinical
Structure Type MOL
InChI Key MJRYUPHPFNSQHX-UHFFFAOYSA-N
Parent Compound CHEMBL3040277
Active Moiety CHEMBL3040277
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
2
Publications
0
Known Names

Molecular Properties

290.4
MW (Da)
0.35
ALogP
6
HBA
2
HBD
56.3
PSA (Ų)
0.84
QED
0
Ro5 Violations
3
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C15H27ClN6
MW 326.88
Aromatic Rings 1
Heavy Atoms 21
NP-Likeness -1.32

Literature References

PubMed DOI Target Context # Activities
23537943 10.1016/j.ejmech.2013.02.020 5-hydroxytryptamine receptor 2C 2
23537943 10.1016/j.ejmech.2013.02.020 5-hydroxytryptamine receptor 2A 1

Data from ChEMBL 36 via Core Engine