COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL017385
Chemical Name: (2Z)-2-cyano-N-methyl-2-[3-(4-methylphenyl)-5-(3-nitrobenzyl)-4-oxo-1,3-thiazolidin-2-ylidene]ethanamide
Smiles: CNC(=O)/C(=C/1\SC(C(=O)N1c1ccc(cc1)C)Cc1cccc(c1)[N+](=O)[O-])/C#N

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Molecular Weight: 422.46
Empirical Formula: C21H18N4O4S

Physical State: Dry powder
Available Amount: 60 mg

Lipinsky:
logP: 2.044
Rotatable bonds: 3
H-donors: 1
H-acceptors: 4
PSA: 144
Number of rings: 3

     

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