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Compound Detail

CHEMBL512334

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Nc1nc(N)nc(NCCCC(N)(C(=O)O)C(F)F)n1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL512334
Phase Preclinical
Structure Type MOL
InChI Key JWMAXRFNPYDNPF-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

291.3
MW (Da)
-0.72
ALogP
8
HBA
5
HBD
166.1
PSA (Ų)
0.41
QED
0
Ro5 Violations
7
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C9H15F2N7O2
MW 291.26
Aromatic Rings 1
Heavy Atoms 20
NP-Likeness -0.46

Literature References

PubMed DOI Target Context # Activities
19250832 10.1016/j.bmc.2009.01.058 Trypanosoma brucei brucei 1

Data from ChEMBL 36 via Core Engine