BO-653

Search structure
Synonyms:
Status: Phase 2
Entry Type: Small molecule
Molecule Category: UNKNOWN
UNII: 2VSP9T5LRX

Structure
InChI Key AGURKSYKTJQPNA-UHFFFAOYSA-N
Smile CCCCCC1(CCCCC)Cc2c(cc(C(C)(C)C)c(O)c2C(C)(C)C)O1
InChI
InChI=1S/C26H44O2/c1-9-11-13-15-26(16-14-12-10-2)18-19-21(28-26)17-20(24(3,4)5)23(27)22(19)25(6,7)8/h17,27H,9-16,18H2,1-8H3

Physicochemical Descriptors

Property Name Value
Molecular Formula C26H44O2
Molecular Weight 388.64
AlogP 7.82
Hydrogen Bond Acceptor 2.0
Hydrogen Bond Donor 1.0
Number of Rotational Bond 8.0
Polar Surface Area 29.46
Molecular species NEUTRAL
Aromatic Rings 1.0
Heavy Atoms 28.0

Indications

Mesh Heading Maximum Phase Reference
Atherosclerosis; Coronary Restenosis; Graft Occlusion, Vascular Phase 2/Phase 3 ClinicalTrials

Cross References

Resources Reference
ChEMBL CHEMBL104186
EPA CompTox DTXSID20166253
FDA SRS 2VSP9T5LRX
PubChem 9800472
SureChEMBL SCHEMBL5055886
ZINC ZINC000001891924
CONTENTS