![CAS 63988-20-5 1′,3′-bis[1,2-diMyristoyl-sn-glycero-3-phospho]-sn-glycerol (aMMoniuM salt) molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/63988-20-5.gif)
CAS RN: 63988-20-5
1′,3′-bis[1,2-diMyristoyl-sn-glycero-3-phospho]-sn-glycerol (aMMoniuM salt)
Product Availability
Choose a grade to view its available package options.
1 package records0 with current stock1 grade group
| Batch No. | Package | Availability | Lead Time | Inquiry |
|---|---|---|---|---|
| Batchno.20250213 | 5mg / 25mg / 100mg | Out of stock | 15 business days | Inquiry |
- Product code: starshine_CAS63988-20-5
- Purity/Analytical Methods: >99.0%
63988-20-5 / azane;[(2R)-3-[[3-[[(2R)-2,3-di(tetradecanoyloxy)propoxy]-hydroxyphosphoryl]oxy-2-hydroxypropoxy]-hydroxyphosphoryl]oxy-2-tetradecanoyloxypropyl] tetradecanoate
Basic Information
CAS
63988-20-5
Multi CAS
Yes
Molecular Formula
C65H129NO17P2
Molecular Weight
1258.700000
Exact Mass
1257.873576
InChI
InChI=1S/C65H126O17P2.2H3N/c1-5-9-13-17-21-25-29-33-37-41-45-49-62(67)75-55-60(81-64(69)51-47-43-39-35-31-27-23-19-15-11-7-3)57-79-83(71,72)77-53-59(66)54-78-84(73,74)80-58-61(82-65(70)52-48-44-40-36-32-28-24-20-16-12-8-4)56-76-63(68)50-46-42-38-34-30-26-22-18-14-10-6-2;;/h59-61,66H,5-58H2,1-4H3,(H,71,72)(H,73,74);2*1H3/t60-,61-;;/m1../s1
InChIKey
WUHLCMIVLGWFSP-MWZRJEOUSA-N
Computed Properties
Structural Parameters
Heavy atom count
85
Fraction Csp3
0.94
Rotatable bonds
66
H-bond acceptors
16
H-bond donors
4
Molar refractivity
340.48
TPSA
271.95
LogP / Solubility
WLOGP
18.49
MLOGP
16.4
XLogP3
18.49
Consensus LogP
17.79
Log S (ESOL)
-14.94
Class (ESOL)
Insoluble
Log S (Ali)
-23.23
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-31.11
Class (SILICOS-IT)
Insoluble
ADME
GI absorption
Low
BBB permeant
No
P-gp substrate
Yes
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
2.73
Drug-likeness / Medicinal Chemistry
Lipinski
No
Ghose
No
Veber
No
Egan
No
Muegge
No
Bioavailability score
0.17
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
6
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