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Compound Detail

CHEMBL5413144

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Cn1c(=O)cc(N2CCN(C(c3ccccc3)c3ccccc3)CC2)c2ccccc21
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL5413144
Phase Preclinical
Structure Type MOL
InChI Key YLVRRXZHHOSMQZ-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
2
Publications
0
Known Names

Molecular Properties

409.5
MW (Da)
4.45
ALogP
4
HBA
0
HBD
28.5
PSA (Ų)
0.50
QED
0
Ro5 Violations
4
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C27H27N3O
MW 409.53
Aromatic Rings 4
Heavy Atoms 31
NP-Likeness -0.82

Literature References

PubMed DOI Target Context # Activities
37465293 10.1021/acsmedchemlett.3c00063 ADMET 2
37465293 10.1021/acsmedchemlett.3c00063 Raji 2

Data from ChEMBL 36 via Core Engine