CAS RN: 319427-45-7

L-Serine, O-(2-methoxyethyl)- (9CI)

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Batchno.20250817 50mg / 100mg / 250mg Out of stock 8-10 business days Inquiry
  • Product code: starshine_CAS319427-45-7
  • Purity/Analytical Methods: >99.0%
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319427-45-7 / (2S)-2-amino-3-(2-methoxyethoxy)propanoic acid

Standard CAS: 319427-45-7 Multi CAS: No

Basic Information

CAS
319427-45-7
Multi CAS
No
Molecular Formula
C6H13NO4
Molecular Weight
163.170000
Exact Mass
163.084458
InChI
InChI=1S/C6H13NO4/c1-10-2-3-11-4-5(7)6(8)9/h5H,2-4,7H2,1H3,(H,8,9)/t5-/m0/s1
InChIKey
ZOMRDSPJEFYHEH-YFKPBYRVSA-N

Computed Properties

Structural Parameters

Heavy atom count
11
Fraction Csp3
0.83
Rotatable bonds
6
H-bond acceptors
4
H-bond donors
2
Molar refractivity
38.31
TPSA
81.78

LogP / Solubility

WLOGP
-0.94
MLOGP
-0.83
XLogP3
-3.7
Consensus LogP
-1.82
Log S (ESOL)
0.14
Class (ESOL)
Highly soluble
Log S (Ali)
-0.22
Class (Ali)
Very soluble
Log S (SILICOS-IT)
-0.66
Class (SILICOS-IT)
Very 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)
-4.38

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
2

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