COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL378315
Chemical Name: (5Z)-3-(4-methoxybenzyl)-5-{[1-(3-nitrophenyl)-1H-pyrrol-2-yl]methylidene}-2-thioxo-1,3-thiazolidin-4-one
Smiles: COc1ccc(cc1)CN1C(=S)S/C(=C\c2cccn2c2cccc(c2)[N+](=O)[O-])/C1=O

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Molecular Weight: 451.53
Empirical Formula: C22H17N3O4S2

Physical State: Dry powder
Available Amount: 603 mg

Lipinsky:
logP: 4.206
Rotatable bonds: 2
H-donors: 0
H-acceptors: 4
PSA: 137
Number of rings: 4

     

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