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Compound Detail

CHEMBL2113977

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Cc1cc(C(=O)N2CCNC(=O)C2)c(C)n1-c1ccccc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL2113977
Phase Preclinical
Structure Type MOL
InChI Key MQCAVDAWVKBHML-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

297.4
MW (Da)
1.67
ALogP
3
HBA
1
HBD
54.3
PSA (Ų)
0.92
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 C17H19N3O2
MW 297.36
Aromatic Rings 2
Heavy Atoms 22
NP-Likeness -1.96

Literature References

PubMed DOI Target Context # Activities
- 10.6019/CHEMBL2113921 Plasmodium falciparum 1

Data from ChEMBL 36 via Core Engine