CAS RN: 20220-62-6
GLYCINE-2-13C
Product Availability
Choose a grade to view its available package options.
3 package records2 with current stock2 grade groups
- Product code: starshine_CAS20220-62-6
- Purity/Analytical Methods: >99.0%
20220-62-6 / 2-aminoacetic acid
Basic Information
CAS
20220-62-6
Multi CAS
No
Molecular Formula
C2H5NO2
Molecular Weight
76.059000
Exact Mass
76.035383
SMILES
[13CH2](C(=O)O)N
InChI
InChI=1S/C2H5NO2/c3-1-2(4)5/h1,3H2,(H,4,5)/i1+1
InChIKey
DHMQDGOQFOQNFH-OUBTZVSYSA-N
Computed Properties
Structural Parameters
Heavy atom count
5
Fraction Csp3
0.5
Rotatable bonds
1
H-bond acceptors
2
H-bond donors
2
Molar refractivity
16.69
TPSA
63.32
LogP / Solubility
WLOGP
-0.97
MLOGP
-0.87
XLogP3
-3.2
Consensus LogP
-1.68
Log S (ESOL)
0.37
Class (ESOL)
Highly soluble
Log S (Ali)
0.53
Class (Ali)
Highly soluble
Log S (SILICOS-IT)
0.54
Class (SILICOS-IT)
Highly soluble
ADME
GI absorption
Low
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-3.87
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
1
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