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Compound Detail

CHEMBL1089641

TRYPAN BLUE FREE ACID
💊 Approved Drug
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💊 Approved Drug
Cc1cc(-c2ccc(/N=N/c3c(S(=O)(=O)O)cc4cc(S(=O)(=O)O)cc(N)c4c3O)c(C)c2)ccc1/N=N/c1c(S(=O)(=O)O)cc2cc(S(=O)(=O)O)cc(N)c2c1O
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1089641
Name TRYPAN BLUE FREE ACID
Phase Approved
Structure Type MOL
InChI Key ZBNARPCCDMHDDV-HVMBLDELSA-N

Known Names

Trypan blue free acid
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
1
Known Names

Molecular Properties

872.9
MW (Da)
6.67
ALogP
16
HBA
8
HBD
359.4
PSA (Ų)
0.04
QED
4
Ro5 Violations
9
Rot. Bonds

Drug Information

Molecule Type Small molecule
First Approval 2004
Availability Prescription
Chirality Achiral

Routes of Administration

Topical

Flags

Natural Product

Extended Properties

Molecular Formula C34H28N6O14S4
MW 872.89
Aromatic Rings 6
Heavy Atoms 58
NP-Likeness -0.25

Data from ChEMBL 36 via Core Engine