[email protected]
CAS 350820-17-6 DL-2-AMINOBUTYRIC-D6 ACID molecular structure lightbox
CAS RN: 350820-17-6

DL-2-AMINOBUTYRIC-D6 ACID

Product Availability

Choose a grade to view its available package options.

1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20250426 5mg / 10mg Out of stock 8-10 business days Inquiry
  • Product code: starshine_CAS350820-17-6
  • Purity/Analytical Methods: >99.0%
GET A QUOTE

350820-17-6 / 2-amino-2,3,3,4,4,4-hexadeuteriobutanoic acid

Standard CAS: 350820-17-6 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
350820-17-6
Multi CAS
Yes
Molecular Formula
C4H9NO2
Molecular Weight
109.160000
Exact Mass
109.100989
InChI
InChI=1S/C4H9NO2/c1-2-3(5)4(6)7/h3H,2,5H2,1H3,(H,6,7)/i1D3,2D2,3D
InChIKey
QWCKQJZIFLGMSD-LIDOUZCJSA-N

Computed Properties

Structural Parameters

Heavy atom count
7
Fraction Csp3
0.75
Rotatable bonds
2
H-bond acceptors
2
H-bond donors
2
Molar refractivity
25.9
TPSA
63.32

LogP / Solubility

WLOGP
-0.19
MLOGP
-0.18
XLogP3
-2.5
Consensus LogP
-0.96
Log S (ESOL)
-0.23
Class (ESOL)
Very soluble
Log S (Ali)
-0.27
Class (Ali)
Very soluble
Log S (SILICOS-IT)
-0.41
Class (SILICOS-IT)
Very soluble

ADME

GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-3.49

Drug-likeness / Medicinal Chemistry

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

Customers Also Viewed

Get In Touch

Contact Us