COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK670474
Chemical Name: dimethyl5-{[(4-chloro-3-{[(2,4-dinitrophenyl)carbonyl]amino}phenyl)sulfonyl]amino}benzene-1,3-dicarboxylate
Smiles: COC(=O)c1cc(cc(c1)C(=O)OC)NS(=O)(=O)c1ccc(c(c1)NC(=O)c1ccc(cc1[N+](=O)[O-])[N+](=O)[O-])Cl

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Molecular Weight: 592.93
Empirical Formula: C23H17ClN4O11S

Physical State: Dry powder
Available Amount: 3 mg

Lipinsky:
logP: 4.038
Rotatable bonds: 6
H-donors: 2
H-acceptors: 11
PSA: 227
Number of rings: 3

     

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