CAS RN: 3608-58-0

3′-DEOXYGUANOSINE

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1 package records1 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250423 100mg / 250mg / 1g Confirm by inquiry Shanghai, Shandong, Hebei Inquiry
  • Product code: starshine_CAS3608-58-0
  • Purity/Analytical Methods: >99.0%
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3608-58-0 / 2-amino-9-[3-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-5H-purin-6-one

Standard CAS: 3608-58-0 Multi CAS: Yes

Basic Information

CAS
3608-58-0
Multi CAS
Yes
Molecular Formula
C10H13N5O4
Molecular Weight
267.240000
Exact Mass
267.096754
InChI
InChI=1S/C10H13N5O4/c11-10-13-7-6(8(18)14-10)12-3-15(7)9-5(17)1-4(2-16)19-9/h3-5,9,16-17H,1-2H2,(H3,11,13,14,18)/t4-,5+,9+/m0/s1
InChIKey
OROIAVZITJBGSM-OBXARNEKSA-N

Computed Properties

Structural Parameters

Heavy atom count
19
Fraction Csp3
0.6
Rotatable bonds
2
H-bond acceptors
8
H-bond donors
3
Molar refractivity
64.55
TPSA
133.1

LogP / Solubility

WLOGP
-2.58
MLOGP
-2.26
XLogP3
-2.5
Consensus LogP
-2.45
Log S (ESOL)
0.26
Class (ESOL)
Highly soluble
Log S (Ali)
0.11
Class (Ali)
Highly soluble
Log S (SILICOS-IT)
0.5
Class (SILICOS-IT)
Highly 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)
-6.18

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
No
Muegge
No
Bioavailability score
0.55
Leadlikeness
Yes
Synthetic Accessibility
3.5

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