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CAS 83024-92-4 LEUKOTRIENE B4 DIMETHYL AMIDE molecular structure lightbox
CAS RN: 83024-92-4

LEUKOTRIENE B4 DIMETHYL AMIDE

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1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20260620 50μg Out of stock 5-7 business days Inquiry
  • Product code: starshine_CAS83024-92-4
  • Purity/Analytical Methods: >99.0%
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83024-92-4 / (5S,12R)-5,12-dihydroxy-N,N-dimethylicosa-6,8,10,14-tetraenamide

Standard CAS: 83024-92-4 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
83024-92-4
Multi CAS
Yes
Molecular Formula
C22H37NO3
Molecular Weight
363.500000
Exact Mass
363.277344
InChI
InChI=1S/C22H37NO3/c1-4-5-6-7-8-11-15-20(24)16-12-9-10-13-17-21(25)18-14-19-22(26)23(2)3/h8-13,16-17,20-21,24-25H,4-7,14-15,18-19H2,1-3H3/b10-9+,11-8-,16-12+,17-13-/t20-,21-/m1/s1
InChIKey
BBJRTSLPWQUASB-UKODYPNASA-N

Computed Properties

Structural Parameters

Heavy atom count
26
Fraction Csp3
0.59
Rotatable bonds
14
H-bond acceptors
3
H-bond donors
2
Molar refractivity
109.88
TPSA
60.77

LogP / Solubility

WLOGP
4.16
MLOGP
3.68
XLogP3
4.1
Consensus LogP
3.98
Log S (ESOL)
-3.79
Class (ESOL)
Poorly soluble
Log S (Ali)
-5.55
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-7.16
Class (SILICOS-IT)
Insoluble

ADME

GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
-1.98

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
Yes
Veber
No
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
3.5

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