General
Preferred name
TRYPAN BLUE
Synonyms
P&D ID
PD052292
CAS
2538-83-2
72-57-1
Tags
natural product
drug
nuisance
available
Drug indication
Ophthalmic surgery injury
Drug Status
approved
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
5
[[ a.name ]]
[[ ligand_id ]]
free of charge
External IDs
24
Properties
(calculated by RDKit )
Molecular Weight
872.05
Hydrogen Bond Acceptors
16
Hydrogen Bond Donors
8
Rotatable Bonds
9
Ring Count
6
Aromatic Ring Count
6
cLogP
6.67
TPSA
359.42
Fraction CSP3
0.06
Chiral centers
0.0
Largest ring
6.0
QED
0.04
Structural alerts
2
azo_A(324)
[#7;!R]=[#7]
PAINS Family A
Optical interference
Light absorption
Nuisance compounds in cellular assays
Related compounds
Custom attributes
(extracted from source data)
Source data
