COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK328901
Chemical Name: (2E)-3-(4-bromophenyl)-N-[(4-ethoxy-2-nitrophenyl)carbamothioyl]prop-2-enamide
Smiles: CCOc1ccc(c(c1)[N+](=O)[O-])NC(=S)NC(=O)/C=C/c1ccc(cc1)Br

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Molecular Weight: 450.31
Empirical Formula: C18H16BrN3O4S

Physical State: Dry powder
Available Amount: 358 mg

Lipinsky:
logP: 5.722
Rotatable bonds: 3
H-donors: 2
H-acceptors: 4
PSA: 128
Number of rings: 2

     

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