COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK701553
Chemical Name: N-[(5Z)-5-{[3-(4-methoxy-3-nitrophenyl)-1-phenyl-1H-pyrazol-4-yl]methylidene}-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]-4-methylbenzamide
Smiles: COc1ccc(cc1[N+](=O)[O-])c1nn(cc1/C=C/1\SC(=S)N(C1=O)NC(=O)c1ccc(cc1)C)c1ccccc1

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Molecular Weight: 571.64
Empirical Formula: C28H21N5O5S2

Physical State: Dry powder
Available Amount: 105 mg

Lipinsky:
logP: 5.62
Rotatable bonds: 4
H-donors: 1
H-acceptors: 5
PSA: 179
Number of rings: 5

     

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