CAS RN: 34693-15-7
Fbp
Product Availability
Available package options are listed below.
1 package records0 with current stock
| Batch No. | Package | Availability | Lead Time | Inquiry |
|---|---|---|---|---|
| Batchno.20250122 | 1g | Out of stock | 15 business days | Inquiry |
- Product code: starshine_CAS34693-15-7
- Purity/Analytical Methods: >99.0%
34693-15-7 / [2,3,4-trihydroxy-5-(phosphonooxymethyl)oxolan-2-yl]methyl dihydrogen phosphate
Basic Information
CAS
34693-15-7
Multi CAS
Yes
Molecular Formula
C6H14O12P2
Molecular Weight
340.120000
Exact Mass
339.996050
InChI
InChI=1S/C6H14O12P2/c7-4-3(1-16-19(10,11)12)18-6(9,5(4)8)2-17-20(13,14)15/h3-5,7-9H,1-2H2,(H2,10,11,12)(H2,13,14,15)/t3-,4-,5+,6-/m1/s1
InChIKey
RNBGYGVWRKECFJ-ARQDHWQXSA-N
Computed Properties
Structural Parameters
Heavy atom count
20
Fraction Csp3
1
Rotatable bonds
6
H-bond acceptors
8
H-bond donors
7
Molar refractivity
57.83
TPSA
203.44
LogP / Solubility
WLOGP
-2.99
MLOGP
-2.61
XLogP3
-5.6
Consensus LogP
-3.73
Log S (ESOL)
0.33
Class (ESOL)
Highly soluble
Log S (Ali)
-0.19
Class (Ali)
Very soluble
Log S (SILICOS-IT)
-0.11
Class (SILICOS-IT)
Very 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)
-6.91
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
No
Egan
No
Muegge
No
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
Yes
Synthetic Accessibility
3.5
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