CAS RN: 25876-88-4
L-Proline, 3-amino-, (3R)- (9CI)
Product Availability
Choose a grade to view its available package options.
1 package records0 with current stock1 grade group
| Batch No. | Package | Availability | Lead Time | Inquiry |
|---|---|---|---|---|
| Batchno.20250915 | 1g | Out of stock | 15 business days | Inquiry |
- Product code: starshine_CAS25876-88-4
- Purity/Analytical Methods: >99.0%
25876-88-4 / (2S,3R)-3-aminopyrrolidine-2-carboxylic acid
Basic Information
CAS
25876-88-4
Multi CAS
No
Molecular Formula
C5H10N2O2
Molecular Weight
130.150000
Exact Mass
130.074228
SMILES
C1CN[C@@H]([C@@H]1N)C(=O)O
InChI
InChI=1S/C5H10N2O2/c6-3-1-2-7-4(3)5(8)9/h3-4,7H,1-2,6H2,(H,8,9)/t3-,4+/m1/s1
InChIKey
VJLXSTXGGXYQCT-DMTCNVIQSA-N
Computed Properties
Structural Parameters
Heavy atom count
9
Fraction Csp3
0.8
Rotatable bonds
1
H-bond acceptors
3
H-bond donors
3
Molar refractivity
32.02
TPSA
75.35
LogP / Solubility
WLOGP
-1.24
MLOGP
-1.1
XLogP3
-3.4
Consensus LogP
-1.91
Log S (ESOL)
0.2
Class (ESOL)
Highly soluble
Log S (Ali)
0.27
Class (Ali)
Highly soluble
Log S (SILICOS-IT)
0.4
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)
-4.39
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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