CAS RN: 866-82-0
Copper citrate
Product Availability
Choose a grade to view its available package options.
1 package records0 with current stock1 grade group
| Batch No. | Package | Availability | Inquiry |
|---|---|---|---|
| Batchno.20250324 | 100g | Out of stock | Inquiry |
- Product code: starshine_CAS866-82-0
- Purity/Analytical Methods: >99.0%
866-82-0 / tricopper bis(2-hydroxypropane-1,2,3-tricarboxylate)
Basic Information
CAS
866-82-0
Multi CAS
Yes
Molecular Formula
C13H10O14U3
Molecular Weight
568.840000
Exact Mass
568.794040
InChI
InChI=1S/2C6H8O7.3Cu/c2*7-3(8)1-6(13,5(11)12)2-4(9)10;;;/h2*13H,1-2H2,(H,7,8)(H,9,10)(H,11,12);;;/q;;3*+2/p-6
InChIKey
STDMRMREKPZQFJ-UHFFFAOYSA-H
Computed Properties
Structural Parameters
Heavy atom count
29
Fraction Csp3
0.5
Rotatable bonds
10
H-bond acceptors
14
H-bond donors
2
Molar refractivity
58.41
TPSA
281.24
LogP / Solubility
WLOGP
-10.51
MLOGP
-9.21
XLogP3
-10.51
Consensus LogP
-10.08
Log S (ESOL)
3.92
Class (ESOL)
Highly soluble
Log S (Ali)
3.37
Class (Ali)
Highly soluble
Log S (SILICOS-IT)
4.17
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)
-13.65
Drug-likeness / Medicinal Chemistry
Lipinski
No
Ghose
No
Veber
No
Egan
No
Muegge
No
Bioavailability score
0.17
Leadlikeness
No
Synthetic Accessibility
2.5
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