CAS RN: 50823-41-1

Glycine, N-4-pyridinyl- (9CI)

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Batchno.20260501 100mg / 500mg Confirm by inquiry Shanghai Inquiry
  • Product code: starshine_CAS50823-41-1
  • Purity/Analytical Methods: >99.0%
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50823-41-1 / 2-(pyridin-4-ylamino)acetic acid

Standard CAS: 50823-41-1 Multi CAS: Yes

Basic Information

CAS
50823-41-1
Multi CAS
Yes
Molecular Formula
C7H8N2O2
Molecular Weight
152.150000
Exact Mass
152.058578
InChI
InChI=1S/C7H8N2O2/c10-7(11)5-9-6-1-3-8-4-2-6/h1-4H,5H2,(H,8,9)(H,10,11)
InChIKey
GEQSSRNYNMKRHP-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
11
Aromatic heavy atom count
6
Fraction Csp3
0.14
Rotatable bonds
3
H-bond acceptors
3
H-bond donors
2
Molar refractivity
40.36
TPSA
62.22

LogP / Solubility

WLOGP
0.58
MLOGP
0.5
XLogP3
0.4
Consensus LogP
0.49
Log S (ESOL)
-1.35
Class (ESOL)
Soluble
Log S (Ali)
-1.23
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.49
Class (SILICOS-IT)
Soluble

ADME

GI absorption
High
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)
-3.24

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
1.5

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