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Compound Detail

CHEMBL2441132

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CC1(C)OC2=C(C(=O)/C(=N\O)c3ccccc32)C1n1cc(-c2ccccc2)nn1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL2441132
Phase Preclinical
Structure Type MOL
InChI Key BUXXDJNNDVPMGG-MOHJPFBDSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

386.4
MW (Da)
3.47
ALogP
7
HBA
1
HBD
89.6
PSA (Ų)
0.54
QED
0
Ro5 Violations
2
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C22H18N4O3
MW 386.41
Aromatic Rings 3
Heavy Atoms 29
NP-Likeness -0.16

Literature References

PubMed DOI Target Context # Activities
24074878 10.1016/j.bmc.2013.08.055 Trypanosoma cruzi 1

Data from ChEMBL 36 via Core Engine