CAS RN: 32248-43-4
Samarium(II) Iodide (ca. 0.1mol/L in Tetrahydrofuran)
Product Availability
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4 package records4 with current stock1 grade group
- Product code: ICTS0494
32248-43-4 / diiodosamarium
Basic Information
CAS
32248-43-4
Multi CAS
Yes
Molecular Formula
I2SM
Molecular Weight
404.200000
Exact Mass
405.728680
InChI
InChI=1S/2HI.Sm/h2*1H;/q;;+2/p-2
InChIKey
UAWABSHMGXMCRK-UHFFFAOYSA-L
Computed Properties
Structural Parameters
Heavy atom count
3
Molar refractivity
28.04
TPSA
0.0000
LogP / Solubility
WLOGP
1.77
MLOGP
1.58
XLogP3
1.77
Consensus LogP
1.71
Log S (ESOL)
-3.46
Class (ESOL)
Poorly soluble
Log S (Ali)
-4.15
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-3.76
Class (SILICOS-IT)
Poorly soluble
ADME
GI absorption
High
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)
-3.93
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
1
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