COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL256831
Chemical Name: 6,6'-[(3,3'-dimethylbiphenyl-4,4'-diyl)di(E)diazene-2,1-diyl]bis(4-amino-5-hydroxynaphthalene-1,3-disulfonate)
Smiles: Cc1cc(ccc1/N=N/c1ccc2c(c1O)c(N)c(cc2S(=O)(=O)[O-])S(=O)(=O)[O-])c1ccc(c(c1)C)/N=N/c1ccc2c(c1O)c(N)c(cc2S(=O)(=O)[O-])S(=O)(=O)[O-]

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Saltdata: 4Na+
Molecular Weight: 868.86
Empirical Formula: C34H24N6O14S4

Physical State: Dry powder
Available Amount: 32 mg

Lipinsky:
logP: 3.209
Rotatable bonds: 3
H-donors: 6
H-acceptors: 14
PSA: 404
Number of rings: 6

     

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