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

CHEMBL1090874

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
COc1nc(Cl)nc(C)c1CCF
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1090874
Phase Preclinical
Structure Type MOL
InChI Key ONZKHZKCSRAVFA-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
5
Publications
0
Known Names

Molecular Properties

204.6
MW (Da)
1.96
ALogP
3
HBA
0
HBD
35.0
PSA (Ų)
0.71
QED
0
Ro5 Violations
3
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C8H10ClFN2O
MW 204.63
Aromatic Rings 1
Heavy Atoms 13
NP-Likeness -1.04

Literature References

PubMed DOI Target Context # Activities
20211564 10.1016/j.bmc.2010.02.023 MOLT-4 1
20211564 10.1016/j.bmc.2010.02.023 HCT-116 1
20211564 10.1016/j.bmc.2010.02.023 SW-620 1
20211564 10.1016/j.bmc.2010.02.023 MCF7 1
20211564 10.1016/j.bmc.2010.02.023 NCI-H460 1

Data from ChEMBL 36 via Core Engine