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CAS 325465-92-7 1-STEAROYL-2-HYDROXY-SN-GLYCERO-3-PHOSPHATE (SODIUM SALT) molecular structure lightbox
CAS RN: 325465-92-7

1-STEAROYL-2-HYDROXY-SN-GLYCERO-3-PHOSPHATE (SODIUM SALT)

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1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20260403 25mg Out of stock 8-10 business days Inquiry
  • Product code: starshine_CAS325465-92-7
  • Purity/Analytical Methods: >99.0%
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325465-92-7 / disodium;(2-hydroxy-3-octadecanoyloxypropyl) phosphate

Standard CAS: 325465-92-7 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
325465-92-7
Multi CAS
Yes
Molecular Formula
C21H41NA2O7P
Molecular Weight
482.500000
Exact Mass
482.238529
InChI
InChI=1S/C21H43O7P.2Na/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-21(23)27-18-20(22)19-28-29(24,25)26;;/h20,22H,2-19H2,1H3,(H2,24,25,26);;/q;2*+1/p-2
InChIKey
CPDDUIFEWSUUJZ-UHFFFAOYSA-L

Computed Properties

Structural Parameters

Heavy atom count
31
Fraction Csp3
0.95
Rotatable bonds
21
H-bond acceptors
7
H-bond donors
1
Molar refractivity
110.07
TPSA
118.95

LogP / Solubility

WLOGP
-1.99
MLOGP
-1.72
XLogP3
-1.99
Consensus LogP
-1.9
Log S (ESOL)
-0.19
Class (ESOL)
Very soluble
Log S (Ali)
-2.08
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-3.66
Class (SILICOS-IT)
Poorly soluble

ADME

GI absorption
Low
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-7.08

Drug-likeness / Medicinal Chemistry

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

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