CAS RN: 37349-30-7
Niobium hydroxide oxide
Product Availability
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2 package records2 with current stock2 grade groups
- Product code: starshine_CAS37349-30-7
- Purity/Analytical Methods: >99.0%
37349-30-7 / tris(niobium(5+));pentakis(oxygen(2-));pentahydroxide
Basic Information
CAS
37349-30-7
Multi CAS
Yes
Molecular Formula
B3H5NO10
Molecular Weight
443.750000
Exact Mass
443.707390
InChI
InChI=1S/3Nb.5H2O.5O/h;;;5*1H2;;;;;/q3*+5;;;;;;5*-2/p-5
InChIKey
CXPMEJFDINASKX-UHFFFAOYSA-I
Computed Properties
Structural Parameters
Heavy atom count
13
H-bond acceptors
5
H-bond donors
5
Molar refractivity
13.11
TPSA
292.5
LogP / Solubility
WLOGP
-1.49
MLOGP
-1.28
XLogP3
-1.49
Consensus LogP
-1.42
Log S (ESOL)
-1.66
Class (ESOL)
Soluble
Log S (Ali)
-2.13
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-1.31
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)
-6.48
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
No
Egan
No
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
1.5
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