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Compound Detail

CHEMBL5400164

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C#CCn1c(=O)c2c(nc(-c3cccc(OC)c3)n2C)n(CCCOP(=O)(O)O)c1=O
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL5400164
Phase Preclinical
Structure Type MOL
InChI Key RBDQWBURUKDZAS-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

448.4
MW (Da)
0.70
ALogP
9
HBA
2
HBD
137.8
PSA (Ų)
0.29
QED
0
Ro5 Violations
8
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C19H21N4O7P
MW 448.37
Aromatic Rings 3
Heavy Atoms 31
NP-Likeness -1.02

Literature References

PubMed DOI Target Context # Activities
37967029 10.1021/acs.jmedchem.3c01013 Unchecked 4

Data from ChEMBL 36 via Core Engine