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Compound Detail

CHEMBL5280809

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CCCNC(=O)C(C)(C)CC(=O)N[C@H]1N=C(c2ccccc2)c2ccccc2N(C)C1=O
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL5280809
Phase Preclinical
Structure Type MOL
InChI Key MUPRPBPCQYRYJW-QFIPXVFZSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

434.5
MW (Da)
2.89
ALogP
4
HBA
2
HBD
90.9
PSA (Ų)
0.70
QED
0
Ro5 Violations
7
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C25H30N4O3
MW 434.54
Aromatic Rings 2
Heavy Atoms 32
NP-Likeness -0.36

Literature References

PubMed DOI Target Context # Activities
37196868 10.1016/j.bmcl.2023.129328 Cryptosporidium parvum 2

Data from ChEMBL 36 via Core Engine