General
Preferred name
Nisin
Synonyms
P&D ID
PD088173
CAS
1414-45-5
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
Other bioactive compounds
[[ a.name ]]
[[ ligand_id ]]
free of charge
External IDs
8
Properties
(calculated by RDKit )
Molecular Weight
3351.55
Hydrogen Bond Acceptors
49
Hydrogen Bond Donors
41
Rotatable Bonds
67
Ring Count
8
Aromatic Ring Count
2
cLogP
-11.47
TPSA
1213.57
Fraction CSP3
0.67
Chiral centers
35.0
Largest ring
22.0
QED
0.02
Structural alerts
0
No structural alerts detected
Related compounds
Custom attributes
(extracted from source data)
Source data
