General
Preferred name
TENYLIDONE
Synonyms
NSC-54902 ()
NSC-760134 ()
P&D ID
PD000190
CAS
893-01-6
Tags
available
drug candidate
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
1
Organisms
0
Compound Sets
3
[[ a.name ]]
[[ ligand_id ]]
free of charge
External IDs
16
Properties
(calculated by RDKit )
Molecular Weight
286.05
Hydrogen Bond Acceptors
3
Hydrogen Bond Donors
0
Rotatable Bonds
2
Ring Count
3
Aromatic Ring Count
2
cLogP
5.03
TPSA
17.07
Fraction CSP3
0.19
Chiral centers
0.0
Largest ring
6.0
QED
0.71
Structural alerts
1
ene_one_ene_A(57)
[#6]=!@[#6](-[!#1])-@[#6](=!@[!#6&!#1])-@[#6](=!@[#6])-[!#1]
PAINS Family B
Related compounds
Custom attributes
(extracted from source data)
Source data
