CAS RN: 29227-88-1

PYR-GLY-OH

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1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20250831 5mg Out of stock 15 business days Inquiry
  • Product code: starshine_CAS29227-88-1
  • Purity/Analytical Methods: >99.0%
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29227-88-1 / 2-[[(2S)-5-oxopyrrolidine-2-carbonyl]amino]acetic acid

Standard CAS: 29227-88-1 Multi CAS: Yes

Basic Information

CAS
29227-88-1
Multi CAS
Yes
Molecular Formula
C7H10N2O4
Molecular Weight
186.170000
Exact Mass
186.064057
InChI
InChI=1S/C7H10N2O4/c10-5-2-1-4(9-5)7(13)8-3-6(11)12/h4H,1-3H2,(H,8,13)(H,9,10)(H,11,12)/t4-/m0/s1
InChIKey
HLPLTUJPJMFPMP-BYPYZUCNSA-N

Computed Properties

Structural Parameters

Heavy atom count
13
Fraction Csp3
0.57
Rotatable bonds
3
H-bond acceptors
3
H-bond donors
3
Molar refractivity
41.81
TPSA
95.5

LogP / Solubility

WLOGP
-1.53
MLOGP
-1.35
XLogP3
-1.4
Consensus LogP
-1.43
Log S (ESOL)
0.17
Class (ESOL)
Highly soluble
Log S (Ali)
0.02
Class (Ali)
Highly soluble
Log S (SILICOS-IT)
0.04
Class (SILICOS-IT)
Highly 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)
-4.94

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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