General
Preferred name
NH2dAdo
Synonyms
5' Amino 5' deoxyadenosine ()
5'Amino5'deoxyadenosine ()
Nsc 238990 ()
5'-Amino-5'-deoxyadenosine ()
P&D ID
PD119852
CAS
14365-44-7
Tags
available
Probe control
Probe control not defined
Orthogonal probes
0
No orthogonal probes found
Similar probes
0
No structurally similar probes found
Structure
P&D probe-likeness score
Structure formats
[[ format ]]
[[ compound[format === 'MOL' ? 'molblock' : format.toLowerCase()] ]]
Description
(extracted from source data)
PRICE
112
DESCRIPTION
5'-Amino-5'-deoxyadenosine (NH2dAdo) is an adenosine kinase inhibitor targeting malignant tumors of the inert lymphatic system with antitumor and anticancer effects. Its mechanism is mediated by the inhibition of DNA synthesis and induction of apoptosis.
(TargetMol Bioactive Compound Library)
[[ p.pathway_name ]]
[[ compound.targets[tid].gene_name ]]
Compound Sets
4
Mcule NIBR MoA Box Subset
Novartis Chemogenetic Library (NIBR MoA Box)
TargetMol Bioactive Compound Library
ZINC Tool Compounds
[[ a.name ]]
[[ ligand_id ]]
free of charge
External IDs
19
Molecular Weight
266.11
Hydrogen Bond Acceptors
9
Hydrogen Bond Donors
4
Rotatable Bonds
2
Ring Count
3
Aromatic Ring Count
2
cLogP
-2.01
TPSA
145.33
Fraction CSP3
0.5
Chiral centers
4.0
Largest ring
6.0
QED
0.49
Structural alerts
0
No structural alerts detected
Related compounds
Custom attributes
(extracted from source data)
Member status
member
MOA
Adenosine kinase inhibitor
Pathway
Apoptosis
GPCR/G protein
Neuroscience
Target
Adenosine Kinase
DNA
Source data
