CAS RN: 59095-76-0
H-GLY-ALA-OME HCL
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.20250906 | 25g | Out of stock | 5-7 business days | Inquiry |
- Product code: starshine_CAS59095-76-0
- Purity/Analytical Methods: >99.0%
59095-76-0 / methyl 2-[(2-aminoacetyl)amino]propanoate;hydrochloride
Basic Information
CAS
59095-76-0
Multi CAS
Yes
Molecular Formula
C6H13CLN2O3
Molecular Weight
196.630000
Exact Mass
196.061470
InChI
InChI=1S/C6H12N2O3.ClH/c1-4(6(10)11-2)8-5(9)3-7;/h4H,3,7H2,1-2H3,(H,8,9);1H/t4-;/m0./s1
InChIKey
MRSZXYSIBHQNOR-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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