COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK018554
Chemical Name: 3-bromo-N-{[2-(4-ethoxyphenyl)-2H-benzotriazol-5-yl]carbamothioyl}benzamide
Smiles: CCOc1ccc(cc1)n1nc2c(n1)cc(cc2)NC(=S)NC(=O)c1cccc(c1)Br

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Molecular Weight: 496.39
Empirical Formula: C22H18BrN5O2S

Physical State: Dry powder
Available Amount: 692 mg

Lipinsky:
logP: 6.093
Rotatable bonds: 2
H-donors: 2
H-acceptors: 2
PSA: 113
Number of rings: 4

     

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