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Compound Detail

CHEMBL3093188

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FC(F)CN1CCC(COc2nc3ccccc3c3ccccc23)CC1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL3093188
Phase Preclinical
Structure Type MOL
InChI Key CQYAZLVMTFZXTP-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

356.4
MW (Da)
4.74
ALogP
3
HBA
0
HBD
25.4
PSA (Ų)
0.62
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 C21H22F2N2O
MW 356.42
Aromatic Rings 3
Heavy Atoms 26
NP-Likeness -1.20

Literature References

PubMed DOI Target Context # Activities
24128816 10.1016/j.bmc.2013.08.061 5-hydroxytryptamine receptor 4 4

Data from ChEMBL 36 via Core Engine