Skip to main content
Free research Free research Free compound review with research home and workspace preview
Quick search ChEMBL 36
Compound Detail

CHEMBL4795665

Enter ChEMBL ID:
Free Research Context This compound will appear in recent viewed items on the research home for this browser.
Research home View demo workspace
CCn1c2c(c3cc(Cl)ccc31)CCNC2C.O=C(O)C(F)(F)F
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL4795665
Phase Preclinical
Structure Type MOL
InChI Key XJBLQBTXUHFIMZ-UHFFFAOYSA-N
Parent Compound CHEMBL4803923
Active Moiety CHEMBL4803923
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
3
Publications
0
Known Names

Molecular Properties

248.8
MW (Da)
3.52
ALogP
2
HBA
1
HBD
17.0
PSA (Ų)
0.82
QED
0
Ro5 Violations
1
Rot. Bonds

Drug Information

Molecule Type Unknown
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C16H18ClF3N2O2
MW 362.78
Aromatic Rings 2
Heavy Atoms 17
NP-Likeness -0.32

Literature References

PubMed DOI Target Context # Activities
32822760 10.1016/j.bmcl.2020.127502 ADMET 1
32822760 10.1016/j.bmcl.2020.127502 BJ 1
32822760 10.1016/j.bmcl.2020.127502 Plasmodium falciparum 1

Data from ChEMBL 36 via Core Engine