CAS RN: 59652-27-6
Guanosine 5′-(trihydrogen diphosphate), trisodium salt
Product Availability
Choose a grade to view its available package options.
1 package records1 with current stock1 grade group
| Batch No. | Package | Availability | Warehouse | Lead Time | Inquiry |
|---|---|---|---|---|---|
| Batchno.20260205 | 10mg / 50mg / 250mg / 1g | Confirm by inquiry | Shanghai | 8-10 business days | Inquiry |
- Product code: starshine_CAS59652-27-6
- Purity/Analytical Methods: >99.0%
59652-27-6 / trisodium;bis((2S,3S,4R,5S)-2-(2-amino-6-oxo-1H-purin-9-yl)-5-[[hydroxy(phosphonooxy)phosphoryl]oxymethyl]oxolane-3,4-diolate);(2R,3R,4S,5R)-2-(2-amino-6-oxo-1H-purin-9-yl)-5-[[hydroxy(phosphonooxy)phosphoryl]oxymethyl]oxolane-3,4-diolate
Basic Information
CAS
59652-27-6
Multi CAS
Yes
Molecular Formula
C30H39N15NA3O33P6-3
Molecular Weight
1392.500000
Exact Mass
1391.995349
InChI
InChI=1S/C10H15N5O11P2.3Na/c11-10-13-7-4(8(18)14-10)12-2-15(7)9-6(17)5(16)3(25-9)1-24-28(22,23)26-27(19,20)21;;;/h2-3,5-6,9,16-17H,1H2,(H,22,23)(H2,19,20,21)(H3,11,13,14,18);;;/q;3*+1/p-3/t3-,5-,6-,9-;;;/m1.../s1
InChIKey
PBVNHDMBCZSEMD-CYCLDIHTSA-K
Computed Properties
Structural Parameters
Heavy atom count
87
Aromatic heavy atom count
27
Fraction Csp3
0.5
Rotatable bonds
18
H-bond acceptors
36
H-bond donors
15
Molar refractivity
248.86
TPSA
774.69
LogP / Solubility
WLOGP
-20.14
MLOGP
-17.58
XLogP3
-20.14
Consensus LogP
-19.29
Log S (ESOL)
5.17
Class (ESOL)
Highly soluble
Log S (Ali)
3.56
Class (Ali)
Highly soluble
Log S (SILICOS-IT)
5.84
Class (SILICOS-IT)
Highly soluble
ADME
GI absorption
Low
BBB permeant
No
P-gp substrate
Yes
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-25.51
Drug-likeness / Medicinal Chemistry
Lipinski
No
Ghose
No
Veber
No
Egan
No
Muegge
No
Bioavailability score
0.17
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
10
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