General
Preferred name
Enniatin A1
Synonyms
P&D ID
PD017801
CAS
4530-21-6
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 ]]
Compound Sets
1
Cayman Chemical Bioactives
[[ a.name ]]
[[ ligand_id ]]
free of charge
External IDs
14
Properties
(calculated by RDKit )
Molecular Weight
667.44
Hydrogen Bond Acceptors
9
Hydrogen Bond Donors
0
Rotatable Bonds
8
Ring Count
1
Aromatic Ring Count
0
cLogP
3.93
TPSA
139.83
Fraction CSP3
0.83
Chiral centers
8.0
Largest ring
18.0
QED
0.28
Structural alerts
0
No structural alerts detected
Related compounds
Custom attributes
(extracted from source data)
Source data
