CAS RN: 77337-73-6
Acamprosate Calcium
Product Availability
Choose a grade to view its available package options.
9 package records5 with current stock3 grade groups
| Batch No. | Package | Availability | Warehouse | Inquiry |
|---|---|---|---|---|
| Batchno.20250730 | 1ml | In stock | Inquiry |
| Batch No. | Package | Availability | Warehouse | Inquiry |
|---|---|---|---|---|
| Batchno.20251019 | 100mg | Out of stock | Inquiry | |
| Batchno.20250628 | 10mg | In stock | Shanghai, Tianjin, Wuhan | Inquiry |
| Batchno.20250811 | 1g | Out of stock | Inquiry | |
| Batchno.20250115 | 1mg | In stock | Shanghai, Tianjin, Wuhan | Inquiry |
| Batchno.20250808 | 250mg | Out of stock | Inquiry | |
| Batchno.20260629 | 5g | Out of stock | Inquiry |
- Product code: ICTA2359
- Purity/Analytical Methods: >98.0%(HPLC)
77337-73-6 / calcium bis(3-acetamidopropane-1-sulfonate)
Basic Information
CAS
77337-73-6
Multi CAS
Yes
Molecular Formula
C10H20CAN2O8S2
Molecular Weight
400.500000
Exact Mass
400.028699
InChI
InChI=1S/2C5H11NO4S.Ca/c2*1-5(7)6-3-2-4-11(8,9)10;/h2*2-4H2,1H3,(H,6,7)(H,8,9,10);/q;;+2/p-2
InChIKey
BUVGWDNTAWHSKI-UHFFFAOYSA-L
Computed Properties
Structural Parameters
Heavy atom count
23
Fraction Csp3
0.8
Rotatable bonds
8
H-bond acceptors
8
H-bond donors
2
Molar refractivity
81.48
TPSA
172.6
LogP / Solubility
WLOGP
-2.27
MLOGP
-1.97
XLogP3
-2.27
Consensus LogP
-2.17
Log S (ESOL)
-0.37
Class (ESOL)
Very soluble
Log S (Ali)
-1.21
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.34
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)
-6.77
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
No
Egan
No
Muegge
No
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
2.5
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