CAS RN: 52603-03-9

1-HEXADECYL LYSOPHOSPHATIDIC ACID

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2 package records1 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20260523 25mg Out of stock 5-7 business days Inquiry
Batchno.20250427 5mg In stock Shanghai Inquiry
  • Product code: starshine_CAS52603-03-9
  • Purity/Analytical Methods: >99.0%
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52603-03-9 / [(2R)-3-hexadecoxy-2-hydroxypropyl] dihydrogen phosphate

Standard CAS: 52603-03-9 Multi CAS: Yes

Basic Information

CAS
52603-03-9
Multi CAS
Yes
Molecular Formula
C19H41O6P
Molecular Weight
396.500000
Exact Mass
396.264076
InChI
InChI=1S/C19H41O6P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-24-17-19(20)18-25-26(21,22)23/h19-20H,2-18H2,1H3,(H2,21,22,23)/t19-/m1/s1
InChIKey
XLVRFPVHQPHXAA-LJQANCHMSA-N

Computed Properties

Structural Parameters

Heavy atom count
26
Fraction Csp3
1
Rotatable bonds
20
H-bond acceptors
4
H-bond donors
3
Molar refractivity
105.13
TPSA
96.22

LogP / Solubility

WLOGP
4.95
MLOGP
4.38
XLogP3
5.4
Consensus LogP
4.91
Log S (ESOL)
-4.1
Class (ESOL)
Slightly soluble
Log S (Ali)
-6.39
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-8.75
Class (SILICOS-IT)
Insoluble

ADME

GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
-1.62

Drug-likeness / Medicinal Chemistry

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

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