COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK368114
Chemical Name: 4,4'-[(2,2'-disulfonatobiphenyl-4,4'-diyl)di(E)diazene-2,1-diyl]bis(5-hydroxy-1-phenyl-1H-pyrazole-3-carboxylate)
Smiles: [O-]C(=O)c1nn(c(c1/N=N/c1ccc(c(c1)S(=O)(=O)[O-])c1ccc(cc1S(=O)(=O)[O-])/N=N/c1c(nn(c1O)c1ccccc1)C(=O)[O-])O)c1ccccc1

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Saltdata: 4Na+
Molecular Weight: 770.67
Empirical Formula: C32H18N8O12S2

Physical State: Dry powder
Available Amount: 80 mg

Lipinsky:
logP: 5.435
Rotatable bonds: 3
H-donors: 2
H-acceptors: 12
PSA: 336
Number of rings: 6

     

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