COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL418653
Chemical Name: (5E)-3-(4-chlorophenyl)-5-{[1-(2-nitrobenzyl)-1H-pyrrol-2-yl]methylidene}-2-thioxo-1,3-thiazolidin-4-one
Smiles: Clc1ccc(cc1)N1C(=S)S/C(=C/c2cccn2Cc2ccccc2[N+](=O)[O-])/C1=O

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Molecular Weight: 455.95
Empirical Formula: C21H14ClN3O3S2

Physical State: Dry powder
Available Amount: 126 mg

Lipinsky:
logP: 5.285
Rotatable bonds: 3
H-donors: 0
H-acceptors: 3
PSA: 128
Number of rings: 4

     

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