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

CHEMBL170194

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
CN(C)CC/N=C(/NC#N)N[C@@H]1c2cc(C#N)ccc2OC(C)(C)[C@H]1O
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL170194
Phase Preclinical
Structure Type MOL
InChI Key GHBLOUSEXUGORM-CVEARBPZSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

356.4
MW (Da)
0.71
ALogP
6
HBA
3
HBD
116.7
PSA (Ų)
0.31
QED
0
Ro5 Violations
4
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C18H24N6O2
MW 356.43
Aromatic Rings 1
Heavy Atoms 26
NP-Likeness -0.01

Literature References

PubMed DOI Target Context # Activities
- 10.1016/S0960-894X(00)80662-9 Rattus norvegicus 1

Data from ChEMBL 36 via Core Engine