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Compound Detail

CHEMBL5180615

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Cc1nc2c(C(=O)N3CCCCC3)cnn2c(C)c1Cc1ccccc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL5180615
Phase Preclinical
Structure Type MOL
InChI Key NNSYJQPRNMBKHX-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
3
Publications
0
Known Names

Molecular Properties

348.4
MW (Da)
3.56
ALogP
4
HBA
0
HBD
50.5
PSA (Ų)
0.73
QED
0
Ro5 Violations
3
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C21H24N4O
MW 348.45
Aromatic Rings 3
Heavy Atoms 26
NP-Likeness -1.73

Literature References

PubMed DOI Target Context # Activities
35364523 10.1016/j.bmc.2022.116726 RuvB-like 1 1
35364523 10.1016/j.bmc.2022.116726 RuvB-like 2 1
35364523 10.1016/j.bmc.2022.116726 Unchecked 1

Data from ChEMBL 36 via Core Engine