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CAS 868-28-0 H-ILE-GLY-OH molecular structure lightbox
CAS RN: 868-28-0

H-ILE-GLY-OH

Product Availability

Choose a grade to view its available package options.

2 package records1 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20251110 100mg In stock Shanghai Inquiry
Batchno.20260220 250mg Out of stock 15 business days Inquiry
  • Product code: starshine_CAS868-28-0
  • Purity/Analytical Methods: >99.0%
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868-28-0 / 2-[(2-amino-3-methylpentanoyl)amino]acetic acid

Standard CAS: 868-28-0 Multi CAS: Yes
Basic Information Physical Properties Computed Properties

Basic Information

CAS
868-28-0
Multi CAS
Yes
Molecular Formula
C8H16N2O3
Molecular Weight
188.220000
Exact Mass
188.116092
InChI
InChI=1S/C8H16N2O3/c1-3-5(2)7(9)8(13)10-4-6(11)12/h5,7H,3-4,9H2,1-2H3,(H,10,13)(H,11,12)
InChIKey
UCGDDTHMMVWVMV-UHFFFAOYSA-N

Physical Properties

Physical Description
Solid
State
Solid

Computed Properties

Structural Parameters

Heavy atom count
13
Fraction Csp3
0.75
Rotatable bonds
5
H-bond acceptors
3
H-bond donors
3
Molar refractivity
48.08
TPSA
92.42

LogP / Solubility

WLOGP
-0.44
MLOGP
-0.39
XLogP3
-2.3
Consensus LogP
-1.04
Log S (ESOL)
-0.4
Class (ESOL)
Very soluble
Log S (Ali)
-0.79
Class (Ali)
Very soluble
Log S (SILICOS-IT)
-1.12
Class (SILICOS-IT)
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)
-4.18

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
2.5

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