COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL483820
Chemical Name: 4,4'-[({4-[(4-sulfophenyl)imino]cyclohexa-2,5-dien-1-ylidene}methanediyl)bis(benzene-4,1-diylimino)]dibenzenesulfonate
Smiles: [O-]S(=O)(=O)c1ccc(cc1)Nc1ccc(cc1)/C(=C/1\C=C/C(=N/c2ccc(cc2)S(=O)(=O)O)/C=C1)/c1ccc(cc1)Nc1ccc(cc1)S(=O)(=O)[O-]

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Saltdata: 2Na+
Molecular Weight: 753.83
Empirical Formula: C37H27N3O9S3

Available Amount: 0 mg

Lipinsky:
logP: 4.192
Rotatable bonds: 1
H-donors: 3
H-acceptors: 9
PSA: 230
Number of rings: 6

     

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