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Compound Detail

CHEMBL3403304

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O=C(Nc1ccc2oc(-c3ccccc3)c(CO)c(=O)c2c1)c1cnccn1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL3403304
Phase Preclinical
Structure Type MOL
InChI Key YMWJYYSHMPNHDV-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

373.4
MW (Da)
2.99
ALogP
6
HBA
2
HBD
105.3
PSA (Ų)
0.57
QED
0
Ro5 Violations
4
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C21H15N3O4
MW 373.37
Aromatic Rings 4
Heavy Atoms 28
NP-Likeness -0.68

Literature References

PubMed DOI Target Context # Activities
25865130 10.1016/j.bmc.2015.03.045 Interleukin-5 2

Data from ChEMBL 36 via Core Engine