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CAS 325466-03-3 bis(MonoMyristoylglycero)phosphate (S,R IsoMer) (aMMoniuM salt) molecular structure lightbox
CAS RN: 325466-03-3

bis(MonoMyristoylglycero)phosphate (S,R IsoMer) (aMMoniuM salt)

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Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20250410 5mg Out of stock 8-10 business days Inquiry
  • Product code: starshine_CAS325466-03-3
  • Purity/Analytical Methods: >99.0%
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325466-03-3 / azane;[2-hydroxy-3-[hydroxy-(2-hydroxy-3-tetradecanoyloxypropoxy)phosphoryl]oxypropyl] tetradecanoate

Standard CAS: 325466-03-3 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
325466-03-3
Multi CAS
Yes
Molecular Formula
C34H70NO10P
Molecular Weight
683.900000
Exact Mass
683.473734
InChI
InChI=1S/C34H67O10P.H3N/c1-3-5-7-9-11-13-15-17-19-21-23-25-33(37)41-27-31(35)29-43-45(39,40)44-30-32(36)28-42-34(38)26-24-22-20-18-16-14-12-10-8-6-4-2;/h31-32,35-36H,3-30H2,1-2H3,(H,39,40);1H3/t31-,32+;
InChIKey
NNTPILCZAQYMLP-CWZMXPKOSA-N

Computed Properties

Structural Parameters

Heavy atom count
46
Fraction Csp3
0.94
Rotatable bonds
34
H-bond acceptors
10
H-bond donors
4
Molar refractivity
182.84
TPSA
183.82

LogP / Solubility

WLOGP
8.49
MLOGP
7.53
XLogP3
8.49
Consensus LogP
8.17
Log S (ESOL)
-7.19
Class (ESOL)
Insoluble
Log S (Ali)
-11.3
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-15.23
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)
-0.86

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
5

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