CAS RN: 1034190-08-3
(S)-3-(2-aMino-3-MethylbutanaMido)propane-1-sulfonic acid
Product Availability
Choose a grade to view its available package options.
6 package records5 with current stock1 grade group
| Batch No. | Package | Availability | Warehouse | Inquiry |
|---|---|---|---|---|
| Batchno.20250713 | 100mg | In stock | Shanghai | Inquiry |
| Batchno.20260131 | 10mg | In stock | Shanghai | Inquiry |
| Batchno.20250522 | 1mg | In stock | Shanghai | Inquiry |
| Batchno.20260204 | 250mg | Out of stock | Inquiry | |
| Batchno.20260122 | 50mg | In stock | Shanghai | Inquiry |
| Batchno.20250605 | 5mg | In stock | Shanghai | Inquiry |
- Product code: starshine_CAS1034190-08-3
- Purity/Analytical Methods: >99.0%
1034190-08-3 / 3-[[(2S)-2-amino-3-methylbutanoyl]amino]propane-1-sulfonic acid
ALZ-801 | VALILTRAMIPROSATE | BLU8499
Basic Information
CAS
1034190-08-3
Multi CAS
Yes
Molecular Formula
C8H18N2O4S
Molecular Weight
238.310000
Exact Mass
238.098728
SMILES
CC(C)[C@@H](C(=O)NCCCS(=O)(=O)O)N
InChI
InChI=1S/C8H18N2O4S/c1-6(2)7(9)8(11)10-4-3-5-15(12,13)14/h6-7H,3-5,9H2,1-2H3,(H,10,11)(H,12,13,14)/t7-/m0/s1
InChIKey
NRZRFNYKMSAZBI-ZETCQYMHSA-N
Synonyms
ALZ-801
VALILTRAMIPROSATE
BLU8499
NRM8499
BLU-8499
Computed Properties
Structural Parameters
Heavy atom count
15
Fraction Csp3
0.88
Rotatable bonds
6
H-bond acceptors
4
H-bond donors
3
Molar refractivity
56.86
TPSA
109.49
LogP / Solubility
WLOGP
-0.64
MLOGP
-0.56
XLogP3
-3
Consensus LogP
-1.4
Log S (ESOL)
-0.52
Class (ESOL)
Very soluble
Log S (Ali)
-1.05
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.4
Class (SILICOS-IT)
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)
-4.63
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
2
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