CAS RN: 63546-27-0
L-ALANINE-3,3,3-D3
Product Availability
Choose a grade to view its available package options.
1 package records1 with current stock1 grade group
| Batch No. | Package | Availability | Warehouse | Inquiry |
|---|---|---|---|---|
| Batchno.20251118 | 10mg / 50mg / 100mg | Confirm by inquiry | Shanghai | Inquiry |
- Product code: starshine_CAS63546-27-0
- Purity/Analytical Methods: >99.0%
63546-27-0 / (2S)-2-amino-3,3,3-trideuteriopropanoic acid
Basic Information
CAS
63546-27-0
Multi CAS
Yes
Molecular Formula
C3H7NO2
Molecular Weight
92.110000
Exact Mass
92.066509
InChI
InChI=1S/C3H7NO2/c1-2(4)3(5)6/h2H,4H2,1H3,(H,5,6)/t2-/m0/s1/i1D3
InChIKey
QNAYBMKLOCPYGJ-VGCLAIIRSA-N
Computed Properties
Structural Parameters
Heavy atom count
6
Fraction Csp3
0.67
Rotatable bonds
1
H-bond acceptors
2
H-bond donors
2
Molar refractivity
21.29
TPSA
63.32
LogP / Solubility
WLOGP
-0.58
MLOGP
-0.53
XLogP3
-3
Consensus LogP
-1.37
Log S (ESOL)
0.04
Class (ESOL)
Highly soluble
Log S (Ali)
0.13
Class (Ali)
Highly soluble
Log S (SILICOS-IT)
0.12
Class (SILICOS-IT)
Highly soluble
ADME
GI absorption
Low
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)
-3.68
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
-
3-Chloro-1-(5-chloro-2-methylphenyl)-1-propanone
- CAS RN: 63549-33-7
- Product Code: SSC-173252
-
3-Chloro-1-(2-chloro-5-methylphenyl)-1-propanone
- CAS RN: 63549-34-8
- Product Code: SSC-173253
-
1-PYRENEBUTYRYL CHLORIDE
- CAS RN: 63549-37-1
- Product Code: starshine_CAS63549-37-1
- Purity/Analytical method: >99.0%
-
-
C3A (70-77)
- CAS RN: 63555-63-5
- Product Code: starshine_CAS63555-63-5
- Purity/Analytical method: >99.0%
-
