General
Preferred name
PD131006
Synonyms
N2-Isobutyryl-5?-O-(4,4?-dimethoxytrityl)-2?-deoxyguanosine ()
P&D ID
PD131006
CAS
127263-01-8
68892-41-1
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()] ]]
[[ p.pathway_name ]]
[[ compound.targets[tid].gene_name ]]
Compound Sets
1
Cayman Chemical Bioactives
[[ a.name ]]
[[ ligand_id ]]
free of charge
External IDs
19
Properties
(calculated by RDKit )
Molecular Weight
639.27
Hydrogen Bond Acceptors
10
Hydrogen Bond Donors
3
Rotatable Bonds
11
Ring Count
6
Aromatic Ring Count
5
cLogP
4.39
TPSA
149.82
Fraction CSP3
0.31
Chiral centers
3.0
Largest ring
6.0
QED
0.18
Structural alerts
0
No structural alerts detected
Related compounds
Custom attributes
(extracted from source data)
Source data
