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CAS 23404-09-3 H-ALA-GLY-OME HCL molecular structure lightbox
CAS RN: 23404-09-3

H-ALA-GLY-OME HCL

Product Availability

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2 package records2 with current stock2 grade groups
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20250630 250mg / 1g / 5g Confirm by inquiry Shanghai, Shandong Inquiry
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20250919 250mg / 1g / 5g Confirm by inquiry Shanghai 8-10 business days Inquiry
  • Product code: starshine_CAS23404-09-3
  • Purity/Analytical Methods: >99.0%
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23404-09-3 / methyl 2-[[(2S)-2-aminopropanoyl]amino]acetate;hydrochloride

Standard CAS: 23404-09-3 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
23404-09-3
Multi CAS
No
Molecular Formula
C6H13ClN2O3
Molecular Weight
196.630000
Exact Mass
196.061470
SMILES
C[C@@H](C(=O)NCC(=O)OC)N.Cl
InChI
InChI=1S/C6H12N2O3.ClH/c1-4(7)6(10)8-3-5(9)11-2;/h4H,3,7H2,1-2H3,(H,8,10);1H/t4-;/m0./s1
InChIKey
YPQGKQWQCHPXLB-WCCKRBBISA-N

Computed Properties

Structural Parameters

Heavy atom count
12
Fraction Csp3
0.67
Rotatable bonds
3
H-bond acceptors
4
H-bond donors
2
Molar refractivity
45.92
TPSA
81.42

LogP / Solubility

WLOGP
-0.96
MLOGP
-0.84
XLogP3
-0.96
Consensus LogP
-0.92
Log S (ESOL)
-0.26
Class (ESOL)
Very soluble
Log S (Ali)
-0.48
Class (Ali)
Very soluble
Log S (SILICOS-IT)
-0.51
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)
-4.6

Drug-likeness / Medicinal Chemistry

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

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