COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK191037
Chemical Name: 5-[(E)-{2-[(3,4,5-trimethoxy-2-nitrophenyl)carbonyl]hydrazinylidene}methyl]furan-2-sulfonate
Smiles: COc1cc(C(=O)N/N=C/c2ccc(o2)S(=O)(=O)[O-])c(c(c1OC)OC)[N+](=O)[O-]

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Saltdata: Na+
Molecular Weight: 428.36
Empirical Formula: C15H14N3O10S

Physical State: Dry powder
Available Amount: 30 mg

Lipinsky:
logP: -0.363
Rotatable bonds: 6
H-donors: 1
H-acceptors: 10
PSA: 193
Number of rings: 2

     

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