General
Preferred name
SENNOSIDE A
Synonyms
NSC 112929 ()
P&D ID
PD080511
CAS
8013-11-4
81-27-6
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 ]]
Cell lines
2
Organisms
0
Compound Sets
3
Cayman Chemical Bioactives
Selleckchem Bioactive Compound Library
TargetMol Bioactive Compound Library
[[ a.name ]]
[[ ligand_id ]]
free of charge
External IDs
25
Properties
(calculated by RDKit )
Molecular Weight
862.2
Hydrogen Bond Acceptors
18
Hydrogen Bond Donors
12
Rotatable Bonds
9
Ring Count
8
Aromatic Ring Count
4
cLogP
-1.1
TPSA
347.96
Fraction CSP3
0.33
Chiral centers
12.0
Largest ring
6.0
QED
0.1
Structural alerts
2
aggregator (Aggregator Advisor)
Aggregators
aggregator (ZINC)
Aggregators
Related compounds
Custom attributes
(extracted from source data)
Pathway
Metabolism
Neuroscience
Target
MAO
Source data
