CAS RN: 439146-24-4

O-ARACHIDONOYL GLYCIDOL

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Batchno.20250910 5mg / 25mg / 100mg Confirm by inquiry Shanghai Inquiry
  • Product code: starshine_CAS439146-24-4
  • Purity/Analytical Methods: >99.0%
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439146-24-4 / oxiran-2-ylmethyl (5Z,8Z,11Z,14Z)-icosa-5,8,11,14-tetraenoate

Standard CAS: 439146-24-4 Multi CAS: Yes

Basic Information

CAS
439146-24-4
Multi CAS
Yes
Molecular Formula
C23H36O3
Molecular Weight
360.500000
Exact Mass
360.266445
InChI
InChI=1S/C23H36O3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-23(24)26-21-22-20-25-22/h6-7,9-10,12-13,15-16,22H,2-5,8,11,14,17-21H2,1H3/b7-6-,10-9-,13-12-,16-15-
InChIKey
ACYNJBAUKQMZDF-DOFZRALJSA-N

Computed Properties

Structural Parameters

Heavy atom count
26
Fraction Csp3
0.61
Rotatable bonds
16
H-bond acceptors
3
Molar refractivity
109.1
TPSA
38.83

LogP / Solubility

WLOGP
6.07
MLOGP
5.36
XLogP3
6.3
Consensus LogP
5.91
Log S (ESOL)
-4.85
Class (ESOL)
Slightly soluble
Log S (Ali)
-6.9
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-8.97
Class (SILICOS-IT)
Insoluble

ADME

GI absorption
Low
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
No
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
-0.61

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
No
Egan
No
Muegge
No
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
3

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