General
Preferred name
cmpd 1
Synonyms
10Z-Hymenialdisine ()
HYMENIALDISINE ()
P&D ID
PD018085
CAS
82005-12-7
Tags
available
drug candidate
Drug indication
Discovery agent
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
7
Organisms
1
Compound Sets
3
[[ a.name ]]
[[ ligand_id ]]
free of charge
External IDs
20
Properties
(calculated by RDKit )
Molecular Weight
323.0
Hydrogen Bond Acceptors
4
Hydrogen Bond Donors
4
Rotatable Bonds
0
Ring Count
3
Aromatic Ring Count
1
cLogP
0.07
TPSA
112.37
Fraction CSP3
0.18
Chiral centers
0.0
Largest ring
7.0
QED
0.51
Structural alerts
0
No structural alerts detected
Related compounds
Custom attributes
(extracted from source data)
Source data
