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Compound Detail

CHEMBL611746

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CC(=O)NCCCCNc1ccc(C(=O)OCCN(C)C)cc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL611746
Phase Preclinical
Structure Type MOL
InChI Key IOQXZHQOQKKKFA-UHFFFAOYSA-N
0
Targets
2
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

321.4
MW (Da)
1.73
ALogP
5
HBA
2
HBD
70.7
PSA (Ų)
0.51
QED
0
Ro5 Violations
10
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C17H27N3O3
MW 321.42
Aromatic Rings 1
Heavy Atoms 23
NP-Likeness -0.91

Activity Summary

Kd 2 meas.

Literature References

PubMed DOI Target Context # Activities
16134947 10.1021/jm0502485 Cyclic nucleotide-gated channel alpha-1 2

Data from ChEMBL 36 via Core Engine