COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK104093
Chemical Name: 5-bromo-2-({[(2E)-3-phenylprop-2-enoyl]carbamothioyl}amino)benzoicacid
Smiles: S=C(Nc1ccc(cc1C(=O)O)Br)NC(=O)/C=C/c1ccccc1

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Molecular Weight: 405.27
Empirical Formula: C17H13BrN2O3S

Physical State: Dry powder
Available Amount: 376 mg

Lipinsky:
logP: 5.803
Rotatable bonds: 3
H-donors: 3
H-acceptors: 3
PSA: 110
Number of rings: 2

     

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