General
Preferred name
MELLICTINE
Synonyms
Methyllycaconitine citrate ()
METHYLLYCACONITINE ()
P&D ID
PD072267
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
2
DrugMatrix
Ki Database
[[ a.name ]]
[[ ligand_id ]]
free of charge
External IDs
12
Properties
(calculated by RDKit )
Molecular Weight
682.35
Hydrogen Bond Acceptors
11
Hydrogen Bond Donors
2
Rotatable Bonds
9
Ring Count
8
Aromatic Ring Count
1
cLogP
2.04
TPSA
144.3
Fraction CSP3
0.76
Chiral centers
14.0
Largest ring
6.0
QED
0.29
Structural alerts
0
No structural alerts detected
Related compounds
Custom attributes
(extracted from source data)
Source data
