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CAS 21160-87-2 L-GLUTAMIC-15N ACID molecular structure lightbox
CAS RN: 21160-87-2

L-GLUTAMIC-15N ACID

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4 package records3 with current stock2 grade groups
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20260201 100mg In stock Inquiry
Batchno.20260102 25mg Out of stock Inquiry
Batchno.20250207 500mg In stock Inquiry
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20260114 100mg In stock Shanghai, Hebei Inquiry
  • Product code: starshine_CAS21160-87-2
  • Purity/Analytical Methods: >99.0%
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21160-87-2 / (2S)-2-(15N)azanylpentanedioic acid

Standard CAS: 21160-87-2 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
21160-87-2
Multi CAS
No
Molecular Formula
C5H9NO4
Molecular Weight
148.120000
Exact Mass
148.050193
SMILES
C(CC(=O)O)[C@@H](C(=O)O)[15NH2]
InChI
InChI=1S/C5H9NO4/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H,7,8)(H,9,10)/t3-/m0/s1/i6+1
InChIKey
WHUUTDBJXJRKMK-OGWWSMAPSA-N

Computed Properties

Structural Parameters

Heavy atom count
10
Fraction Csp3
0.6
Rotatable bonds
4
H-bond acceptors
3
H-bond donors
3
Molar refractivity
32.48
TPSA
100.62

LogP / Solubility

WLOGP
-0.74
MLOGP
-0.65
XLogP3
-3.7
Consensus LogP
-1.7
Log S (ESOL)
-0.02
Class (ESOL)
Very soluble
Log S (Ali)
-0.23
Class (Ali)
Very soluble
Log S (SILICOS-IT)
-0.48
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)
-4.14

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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