General
Preferred name
Angoroside C
Synonyms
P&D ID
PD087391
CAS
115909-22-3
Tags
natural product
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
3
MedChem Express Bioactive Compound Library
Selleckchem Bioactive Compound Library
TargetMol Bioactive Compound Library
[[ a.name ]]
[[ ligand_id ]]
free of charge
External IDs
10
Properties
(calculated by RDKit )
Molecular Weight
784.28
Hydrogen Bond Acceptors
19
Hydrogen Bond Donors
9
Rotatable Bonds
14
Ring Count
5
Aromatic Ring Count
2
cLogP
-1.95
TPSA
282.21
Fraction CSP3
0.58
Chiral centers
14.0
Largest ring
6.0
QED
0.07
Structural alerts
0
No structural alerts detected
Related compounds
Custom attributes
(extracted from source data)
Pathway
GPCR/G protein
Target
PGE2
Immunology & Inflammation related
MOA
Prostaglandin Receptor inhibitor
Source data
