CAS RN: 20110-59-2

GLYCINE-1-13C

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1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20251127 1g Out of stock 5-7 business days Inquiry
  • Product code: starshine_CAS20110-59-2
  • Purity/Analytical Methods: >99.0%
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20110-59-2 / 2-aminoacetic acid

Standard CAS: 20110-59-2 Multi CAS: No

Basic Information

CAS
20110-59-2
Multi CAS
No
Molecular Formula
C2H5NO2
Molecular Weight
76.059000
Exact Mass
76.035383
SMILES
C([13C](=O)O)N
InChI
InChI=1S/C2H5NO2/c3-1-2(4)5/h1,3H2,(H,4,5)/i2+1
InChIKey
DHMQDGOQFOQNFH-VQEHIDDOSA-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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