General
Preferred name
THIOINOSINE
Synonyms
6-Mercaptopurine riboside ()
6TI ()
6-​Thioinosine ()
Nsc-4911 ()
Mercaptopurine ribonucleoside ()
6-?Thioinosine ()
P&D ID
PD158803
CAS
4988-64-1
574-25-4
Tags
available
drug candidate
Structure
Probe scores
P&D probe-likeness score
[[ v.score ]]%
Structure formats
[[ format ]]
[[ compound[format === 'MOL' ? 'molblock' : format.toLowerCase()] ]]
Description
(extracted from source data)
PRICE 83
DESCRIPTION 6-Thioinosine (6TI) is a purine antimetabolite, acts as an anti-adipogenesis agent. (TargetMol Bioactive Compound Library)
Cell lines
3
Organisms
1
Compound Sets
3
Cayman Chemical Bioactives
ChEMBL Drugs
TargetMol Bioactive Compound Library
External IDs
23
Properties
(calculated by RDKit )
Molecular Weight
284.06
Hydrogen Bond Acceptors
9
Hydrogen Bond Donors
4
Rotatable Bonds
2
Ring Count
3
Aromatic Ring Count
2
cLogP
-1.27
TPSA
113.52
Fraction CSP3
0.5
Chiral centers
4.0
Largest ring
6.0
QED
0.4
Structural alerts
0
No structural alerts detected
Custom attributes
(extracted from source data)
Target
Nucleoside antimetabolite/analog
Pathway
Cell Cycle/Checkpoint
DNA Damage/DNA Repair
Source data