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

CHEMBL1688244

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
Cc1ncnc(C)c1C(=O)N1CCC(C)(N2CCN([C@H]3c4ccc(C(F)(F)F)cc4C[C@@H]3O)[C@@H](C)C2)CC1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1688244
Phase Preclinical
Structure Type MOL
InChI Key YUVBUIGMINTUIE-XPEQFSOGSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

531.6
MW (Da)
3.77
ALogP
6
HBA
1
HBD
72.8
PSA (Ų)
0.65
QED
1
Ro5 Violations
3
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C28H36F3N5O2
MW 531.62
Aromatic Rings 2
Heavy Atoms 38
NP-Likeness -0.30

Literature References

PubMed DOI Target Context # Activities
24900235 10.1021/ml1001536 C-C chemokine receptor type 5 1

Data from ChEMBL 36 via Core Engine