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Compound Detail

CHEMBL5271513

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

Basic Information

ChEMBL ID CHEMBL5271513
Phase Preclinical
Structure Type MOL
InChI Key QPOSTDJODUJNBE-FDDCHVKYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

502.5
MW (Da)
3.82
ALogP
4
HBA
2
HBD
90.9
PSA (Ų)
0.55
QED
1
Ro5 Violations
9
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C26H29F3N4O3
MW 502.54
Aromatic Rings 2
Heavy Atoms 36
NP-Likeness -0.30

Literature References

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

Data from ChEMBL 36 via Core Engine