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

CHEMBL451346

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
CC1=C2C[C@H]3[C@@H](CCC4=CC(=O)CC[C@@]43C)[C@@H]2CC[C@@]2(C1)O[C@@H]1C[C@H](C)CN(CCOCCO)[C@H]1[C@H]2C
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL451346
Phase Preclinical
Structure Type MOL
InChI Key POZPSJCTQZWKPG-VPEWNQRDSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

511.8
MW (Da)
5.32
ALogP
5
HBA
1
HBD
59.0
PSA (Ų)
0.40
QED
2
Ro5 Violations
5
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C32H49NO4
MW 511.75
Aromatic Rings 0
Heavy Atoms 37
NP-Likeness 1.66

Literature References

PubMed DOI Target Context # Activities
18842035 10.1021/jm8008508 Molecular identity unknown 1

Data from ChEMBL 36 via Core Engine