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CAS 52715-93-2 H-DL-MET-DL-MET-OH molecular structure lightbox
CAS RN: 52715-93-2

H-DL-MET-DL-MET-OH

Product Availability

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1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20251209 50mg Out of stock 15 business days Inquiry
  • Product code: starshine_CAS52715-93-2
  • Purity/Analytical Methods: >99.0%
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52715-93-2 / 2-[(2-amino-4-methylsulfanylbutanoyl)amino]-4-methylsulfanylbutanoic acid

Standard CAS: 52715-93-2 Multi CAS: Yes
Basic Information Physical Properties Computed Properties

Basic Information

CAS
52715-93-2
Multi CAS
Yes
Molecular Formula
C10H20N2O3S2
Molecular Weight
280.400000
Exact Mass
280.091535
InChI
InChI=1S/C10H20N2O3S2/c1-16-5-3-7(11)9(13)12-8(10(14)15)4-6-17-2/h7-8H,3-6,11H2,1-2H3,(H,12,13)(H,14,15)
InChIKey
ZYTPOUNUXRBYGW-UHFFFAOYSA-N

Physical Properties

Physical Description
Solid
State
Solid

Computed Properties

Structural Parameters

Heavy atom count
17
Fraction Csp3
0.8
Rotatable bonds
9
H-bond acceptors
5
H-bond donors
3
Molar refractivity
73.54
TPSA
92.42

LogP / Solubility

WLOGP
0.39
MLOGP
0.35
XLogP3
-2.6
Consensus LogP
-0.62
Log S (ESOL)
-1.23
Class (ESOL)
Soluble
Log S (Ali)
-2.14
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.89
Class (SILICOS-IT)
Moderately soluble

ADME

GI absorption
High
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)
-4.15

Drug-likeness / Medicinal Chemistry

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

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