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

CHEMBL130626

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
CCCCCCCCC(=O)O[C@@H]1[C@@H](C)[C@@]2(O)[C@@H](C=C(CO)C[C@@]3(O)C(=O)C(C)=C[C@@H]23)[C@@H]2C(C)(C)[C@]12OC(=O)CCCCCCCC
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL130626
Phase Preclinical
Structure Type MOL
InChI Key MCOPJFWROQYMMR-VUQSLQLNSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

644.9
MW (Da)
6.53
ALogP
8
HBA
3
HBD
130.4
PSA (Ų)
0.09
QED
2
Ro5 Violations
17
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C38H60O8
MW 644.89
Aromatic Rings 0
Heavy Atoms 46
NP-Likeness 2.21

Literature References

PubMed DOI Target Context # Activities
19361196 10.1021/jm9001007 Transient receptor potential cation channel subfamily V member 4 1

Data from ChEMBL 36 via Core Engine