COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL119477
Chemical Name: dimethyl2-({N-(2,4-dimethoxyphenyl)-N-[(2-nitrophenyl)sulfonyl]glycyl}amino)benzene-1,4-dicarboxylate
Smiles: COc1ccc(c(c1)OC)N(S(=O)(=O)c1ccccc1[N+](=O)[O-])CC(=O)Nc1cc(ccc1C(=O)OC)C(=O)OC

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Molecular Weight: 587.56
Empirical Formula: C26H25N3O11S

Physical State: Dry powder
Available Amount: 97 mg

Lipinsky:
logP: 2.488
Rotatable bonds: 9
H-donors: 1
H-acceptors: 11
PSA: 191
Number of rings: 3

     

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