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CAS 13716-89-7 H-GLU-GLY-OH molecular structure lightbox
CAS RN: 13716-89-7

H-GLU-GLY-OH

  • Product code: SSC-046648
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Historical Factory Record

Historical Supply Reference

This product has historical factory records. Recorded pack sizes and purity can be used as a supply reference, while project-specific availability is confirmed by inquiry.

  • Pack sizes on record: 1g
  • Available purity: ≥95%
  • Inventory rows with stock: 0
  • Bulk packaging: confirmed by inquiry
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Reference Pack Sizes

Reference pack sizes are shown below. Final availability, packaging and delivery schedule are confirmed by inquiry.

Recorded sizes, purity and stock details for CAS 13716-89-7
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ≥95% 0 Out of Stock Shenzhen Inquiry

13716-89-7 / (4S)-4-amino-5-(carboxymethylamino)-5-oxopentanoic acid

Standard CAS: 13716-89-7 Multi CAS: No
Basic Information Physical Properties Computed Properties Safety & Transport

Basic Information

CAS
13716-89-7
Multi CAS
No
Molecular Formula
C7H12N2O5
Molecular Weight
204.180000
Exact Mass
204.074621
SMILES
C(CC(=O)O)[C@@H](C(=O)NCC(=O)O)N
InChI
InChI=1S/C7H12N2O5/c8-4(1-2-5(10)11)7(14)9-3-6(12)13/h4H,1-3,8H2,(H,9,14)(H,10,11)(H,12,13)/t4-/m0/s1
InChIKey
LSPKYLAFTPBWIL-BYPYZUCNSA-N

Physical Properties

Physical Description
Solid
State
Solid

Computed Properties

Structural Parameters

Heavy atom count
14
Fraction Csp3
0.57
Rotatable bonds
6
H-bond acceptors
4
H-bond donors
4
Molar refractivity
45.49
TPSA
129.72

LogP / Solubility

WLOGP
-1.62
MLOGP
-1.43
XLogP3
-4.2
Consensus LogP
-2.42
Log S (ESOL)
0.31
Class (ESOL)
Highly soluble
Log S (Ali)
-0.06
Class (Ali)
Very soluble
Log S (SILICOS-IT)
-0.36
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)
-5.12

Drug-likeness / Medicinal Chemistry

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

Safety & Transport

Pictogram(s)
Irritant
Signal
Warning
GHS Hazard Statements
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
Precautionary Statement Codes
P264, P270, P301+P317, P330, and P501

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