General
Preferred name
N-Demethylerythromycin A
Synonyms
P&D ID
PD121729
CAS
992-62-1
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
12
Properties
(calculated by RDKit )
Molecular Weight
719.45
Hydrogen Bond Acceptors
14
Hydrogen Bond Donors
6
Rotatable Bonds
7
Ring Count
3
Aromatic Ring Count
0
cLogP
1.44
TPSA
202.7
Fraction CSP3
0.94
Chiral centers
18.0
Largest ring
14.0
QED
0.21
Structural alerts
0
No structural alerts detected
Related compounds
Custom attributes
(extracted from source data)
Source data
