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

CHEMBL2027886

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@H]1C[N@+]2(Cc3cc(C(C)(C)C)c(OC)c(C(C)(C)C)c3)CC[C@H]1C[C@H]2[C@H](OCc1ccccc1)c1ccnc2ccccc12

Basic Information

ChEMBL ID CHEMBL2027886
Phase Preclinical
Structure Type MOL
InChI Key MERAXBYJOYQTOA-UWQDQIAWSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

617.9
MW (Da)
9.71
ALogP
3
HBA
0
HBD
31.4
PSA (Ų)
0.14
QED
2
Ro5 Violations
9
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C42H53N2O2+
MW 617.90
Aromatic Rings 4
Heavy Atoms 46
NP-Likeness 0.50

Data from ChEMBL 36 via Core Engine