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Compound Detail

CHEMBL116955

CONGO RED FREE ACID
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Nc1c(/N=N/c2ccc(-c3ccc(/N=N/c4cc(S(=O)(=O)O)c5ccccc5c4N)cc3)cc2)cc(S(=O)(=O)O)c2ccccc12
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL116955
Name CONGO RED FREE ACID
Phase Preclinical
Structure Type MOL
InChI Key HFHIDKQMGIGARX-ATXIYDNESA-N

Known Names

C.i. direct red 28 free acid Congo red free acid
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
2
Known Names

Molecular Properties

652.7
MW (Da)
8.15
ALogP
10
HBA
4
HBD
210.2
PSA (Ų)
0.07
QED
2
Ro5 Violations
7
Rot. Bonds

Drug Information

Molecule Type Small molecule
Chirality Achiral

Flags

Natural Product

Extended Properties

Molecular Formula C32H24N6O6S2
MW 652.71
Aromatic Rings 6
Heavy Atoms 46
NP-Likeness -0.24

Data from ChEMBL 36 via Core Engine