COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK841159
Chemical Name: (2E)-3-(3,4-dimethoxyphenyl)-N-[(4-ethoxy-2-nitrophenyl)carbamothioyl]prop-2-enamide
Smiles: CCOc1ccc(c(c1)[N+](=O)[O-])NC(=S)NC(=O)/C=C/c1ccc(c(c1)OC)OC

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Molecular Weight: 431.47
Empirical Formula: C20H21N3O6S

Physical State: Dry powder
Available Amount: 258 mg

Lipinsky:
logP: 4.658
Rotatable bonds: 6
H-donors: 2
H-acceptors: 6
PSA: 146
Number of rings: 2

     

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