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

CHEMBL2068994

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
C=C(C)[C@@H]1CC[C@]2(N=C=O)CC[C@@]3(C)C(CC[C@@H]4[C@@]5(C)CCC(=O)C(C)(C)C5CC[C@]43C)C12
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL2068994
Phase Preclinical
Structure Type MOL
InChI Key VQWHXXYGQNAQAN-KROBPHRISA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
2
Publications
0
Known Names

Molecular Properties

451.7
MW (Da)
7.30
ALogP
3
HBA
0
HBD
46.5
PSA (Ų)
0.25
QED
1
Ro5 Violations
2
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

Natural Product First in Class Prodrug

Extended Properties

Molecular Formula C30H45NO2
MW 451.70
Aromatic Rings 0
Heavy Atoms 33
NP-Likeness 2.62

Literature References

PubMed DOI Target Context # Activities
14505668 10.1016/s0960-894x(03)00714-5 Influenza A virus 2
14505668 10.1016/s0960-894x(03)00714-5 Human alphaherpesvirus 1 2

Data from ChEMBL 36 via Core Engine