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

CHEMBL73214

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
CCSc1ccc2ncc(-c3ccnc(Nc4ccc(S(=O)(=O)NCCOC)cc4)n3)n2c1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL73214
Phase Preclinical
Structure Type MOL
InChI Key RUMYYOSNSRQLJJ-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

484.6
MW (Da)
3.57
ALogP
9
HBA
2
HBD
110.5
PSA (Ų)
0.26
QED
0
Ro5 Violations
10
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C22H24N6O3S2
MW 484.61
Aromatic Rings 4
Heavy Atoms 33
NP-Likeness -2.03

Literature References

PubMed DOI Target Context # Activities
15081017 10.1016/j.bmcl.2004.02.015 Cyclin-dependent kinase 2 1

Data from ChEMBL 36 via Core Engine