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Compound Detail

CHEMBL5595327

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CN1CCN(c2ccc(-c3cnc4c(-c5coc6ccccc56)coc4c3)cc2)CC1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL5595327
Phase Preclinical
Structure Type MOL
InChI Key IIEKSAPAOYUYQM-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
6
Publications
0
Known Names

Molecular Properties

409.5
MW (Da)
5.66
ALogP
5
HBA
0
HBD
45.6
PSA (Ų)
0.38
QED
1
Ro5 Violations
3
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C26H23N3O2
MW 409.49
Aromatic Rings 5
Heavy Atoms 31
NP-Likeness -0.68

Literature References

PubMed DOI Target Context # Activities
39023313 10.1021/acs.jmedchem.4c00629 Activin receptor type-1-like 1
39023313 10.1021/acs.jmedchem.4c00629 Activin receptor type-1 1
39023313 10.1021/acs.jmedchem.4c00629 Bone morphogenetic protein receptor type-1A 1
39023313 10.1021/acs.jmedchem.4c00629 Activin receptor type-1B 1
39023313 10.1021/acs.jmedchem.4c00629 TGF-beta receptor type-1 1
39023313 10.1021/acs.jmedchem.4c00629 Bone morphogenetic protein receptor type-1B 1

Data from ChEMBL 36 via Core Engine