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CAS 6027-83-4 3′-GMP DISODIUM SALT molecular structure lightbox
CAS RN: 6027-83-4

3′-GMP DISODIUM SALT

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5 package records5 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20260416 100mg In stock Shanghai Inquiry
Batchno.20251129 100mg In stock Inquiry
Batchno.20251204 250mg In stock Shanghai, Shandong Inquiry
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Batchno.20251217 25mg In stock Inquiry
  • Product code: starshine_CAS6027-83-4
  • Purity/Analytical Methods: >99.0%
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6027-83-4 / disodium;[(2R,3R,4R,5R)-2-(2-amino-6-oxidopurin-9-yl)-4-hydroxy-5-(hydroxymethyl)oxolan-3-yl] hydrogen phosphate

Standard CAS: 6027-83-4 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
6027-83-4
Multi CAS
Yes
Molecular Formula
C10H12N5NA2O8P
Molecular Weight
407.180000
Exact Mass
407.021888
InChI
InChI=1S/C10H14N5O8P.2Na/c11-10-13-7-4(8(18)14-10)12-2-15(7)9-5(17)6(3(1-16)22-9)23-24(19,20)21;;/h2-3,5-6,9,16-17H,1H2,(H2,19,20,21)(H3,11,13,14,18);;/q;2*+1/p-2/t3-,5-,6-,9-;;/m1../s1
InChIKey
QFYOUTHOUPZZES-LGVAUZIVSA-L

Computed Properties

Structural Parameters

Heavy atom count
26
Aromatic heavy atom count
9
Fraction Csp3
0.5
Rotatable bonds
4
H-bond acceptors
12
H-bond donors
4
Molar refractivity
70.88
TPSA
211.96

LogP / Solubility

WLOGP
-9.41
MLOGP
-8.26
XLogP3
-9.41
Consensus LogP
-9.03
Log S (ESOL)
3.57
Class (ESOL)
Highly soluble
Log S (Ali)
3.9
Class (Ali)
Highly soluble
Log S (SILICOS-IT)
5.03
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)
-11.89

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
No
Egan
No
Muegge
No
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
5

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