General
Preferred name
TOLUIDINE BLUE O
Synonyms
P&D ID
PD055318
CAS
98104-93-9
1336-01-2
Tags
available
Structure
Probe scores
P&D probe-likeness score
[[ v.score ]]%
Structure formats
[[ format ]]
[[ compound[format === 'MOL' ? 'molblock' : format.toLowerCase()] ]]
Compound Sets
1
Other bioactive compounds
External IDs
13
Properties
(calculated by RDKit )
Molecular Weight
305.08
Hydrogen Bond Acceptors
3
Hydrogen Bond Donors
1
Rotatable Bonds
0
Ring Count
3
Aromatic Ring Count
1
cLogP
-0.67
TPSA
41.92
Fraction CSP3
0.2
Chiral centers
0.0
Largest ring
6.0
QED
0.34
Structural alerts
0
No structural alerts detected
Custom attributes
(extracted from source data)
Source data