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

CHEMBL1098825

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
Nc1n[nH]c2nc(N3CCCCC3)c3c(c12)CCN(C(=O)c1ccc(F)cc1)C3
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1098825
Phase Preclinical
Structure Type MOL
InChI Key RTRVVHLTJHRRNU-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

394.4
MW (Da)
2.87
ALogP
5
HBA
2
HBD
91.1
PSA (Ų)
0.70
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 C21H23FN6O
MW 394.45
Aromatic Rings 3
Heavy Atoms 29
NP-Likeness -1.53

Literature References

PubMed DOI Target Context # Activities
20371178 10.1016/j.bmcl.2010.03.065 Bombesin receptor subtype-3 2

Data from ChEMBL 36 via Core Engine