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CAS 4338-47-0 KINETIN RIBOSIDE molecular structure lightbox
CAS RN: 4338-47-0

KINETIN RIBOSIDE

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2 package records2 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20251221 100mg In stock Shanghai, Shandong Inquiry
Batchno.20250430 500mg In stock Shanghai Inquiry
  • Product code: starshine_CAS4338-47-0
  • Purity/Analytical Methods: >99.0%
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4338-47-0 / 2-[6-(furan-2-ylmethylamino)purin-9-yl]-5-(hydroxymethyl)oxolane-3,4-diol

Standard CAS: 4338-47-0 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
4338-47-0
Multi CAS
Yes
Molecular Formula
C15H17N5O5
Molecular Weight
347.330000
Exact Mass
347.122969
InChI
InChI=1S/C15H17N5O5/c21-5-9-11(22)12(23)15(25-9)20-7-19-10-13(17-6-18-14(10)20)16-4-8-2-1-3-24-8/h1-3,6-7,9,11-12,15,21-23H,4-5H2,(H,16,17,18)/t9-,11-,12-,15-/m1/s1
InChIKey
CAGLGYNQQSIUGX-SDBHATRESA-N

Computed Properties

Structural Parameters

Heavy atom count
25
Aromatic heavy atom count
14
Fraction Csp3
0.4
Rotatable bonds
5
H-bond acceptors
10
H-bond donors
4
Molar refractivity
84.37
TPSA
138.69

LogP / Solubility

WLOGP
-0.36
MLOGP
-0.3
XLogP3
0.2
Consensus LogP
-0.15
Log S (ESOL)
-1.85
Class (ESOL)
Soluble
Log S (Ali)
-2.15
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.22
Class (SILICOS-IT)
Moderately 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)
-5.09

Drug-likeness / Medicinal Chemistry

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

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