COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL374749
Chemical Name: (5Z)-3-(4-bromobenzyl)-5-{[1-(3-nitrophenyl)-1H-pyrrol-2-yl]methylidene}-1,3-thiazolidine-2,4-dione
Smiles: Brc1ccc(cc1)CN1C(=O)S/C(=C\c2cccn2c2cccc(c2)[N+](=O)[O-])/C1=O

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Molecular Weight: 484.33
Empirical Formula: C21H14BrN3O4S

Physical State: Dry powder
Available Amount: 116 mg

Lipinsky:
logP: 5.594
Rotatable bonds: 2
H-donors: 0
H-acceptors: 4
PSA: 113
Number of rings: 4

     

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