General
Preferred name
cADPR
Synonyms
Cyclic ADP-Ribose (ammonium salt) ()
P&D ID
PD046489
CAS
119340-53-3
Tags
drug candidate
natural product
available
Drug indication
Discovery agent
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
7
[[ a.name ]]
[[ ligand_id ]]
free of charge
External IDs
21
Properties
(calculated by RDKit )
Molecular Weight
541.06
Hydrogen Bond Acceptors
16
Hydrogen Bond Donors
7
Rotatable Bonds
0
Ring Count
6
Aromatic Ring Count
2
cLogP
-2.79
TPSA
261.16
Fraction CSP3
0.67
Chiral centers
12.0
Largest ring
18.0
QED
0.17
Structural alerts
0
No structural alerts detected
Related compounds
Custom attributes
(extracted from source data)
Source data
