CAS RN: 3507-99-1
Silver(I) stearate
Product Availability
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4 package records3 with current stock2 grade groups
- Product code: LINS922965
3507-99-1 / silver octadecanoate
Basic Information
CAS
3507-99-1
Multi CAS
Yes
Molecular Formula
AgC18H35O2
Molecular Weight
391.300000
Exact Mass
390.168800
InChI
InChI=1S/C18H36O2.Ag/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20;/h2-17H2,1H3,(H,19,20);/q;+1/p-1
InChIKey
ORYURPRSXLUCSS-UHFFFAOYSA-M
Computed Properties
Structural Parameters
Heavy atom count
21
Fraction Csp3
0.94
Rotatable bonds
16
H-bond acceptors
2
Molar refractivity
84.55
TPSA
40.13
LogP / Solubility
WLOGP
5
MLOGP
4.42
XLogP3
5
Consensus LogP
4.81
Log S (ESOL)
-4.36
Class (ESOL)
Slightly soluble
Log S (Ali)
-6.38
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-8.27
Class (SILICOS-IT)
Insoluble
ADME
GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
No
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
-1.56
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
Yes
Veber
No
Egan
Yes
Muegge
No
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
2.5
