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Compound Detail

CHEMBL1241233

CYCLOPOSINE
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CC1=C2C[C@H]3[C@@H](CC=C4C[C@@H](O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)CC[C@@]43C)[C@@H]2CC[C@]12O[C@@H]1C[C@H](C)CN[C@H]1[C@H]2C
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1241233
Name CYCLOPOSINE
Phase Preclinical
Structure Type MOL
InChI Key OSOOWXRUSUHLOX-PBFVMIKGSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

573.8
MW (Da)
2.83
ALogP
8
HBA
5
HBD
120.6
PSA (Ų)
0.33
QED
1
Ro5 Violations
3
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

Natural Product First in Class Prodrug

Extended Properties

Molecular Formula C33H51NO7
MW 573.77
Aromatic Rings 0
Heavy Atoms 41
NP-Likeness 2.90

Literature References

PubMed DOI Target Context # Activities
20708941 10.1016/j.bmc.2010.07.038 Unchecked 1

Data from ChEMBL 36 via Core Engine