COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL355668
Chemical Name: 4-chloro-3-({[(4-methoxy-3-nitrophenyl)carbonyl]carbamothioyl}amino)benzoicacid
Smiles: COc1ccc(cc1[N+](=O)[O-])C(=O)NC(=S)Nc1cc(ccc1Cl)C(=O)O

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Molecular Weight: 409.81
Empirical Formula: C16H12ClN3O6S

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 3.453
Rotatable bonds: 4
H-donors: 3
H-acceptors: 6
PSA: 165
Number of rings: 2

     

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