COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK088616
Chemical Name: (2Z,5Z)-3-benzyl-5-(4-hydroxy-3-methoxy-5-nitrobenzylidene)-2-[(4-methylphenyl)imino]-1,3-thiazolidin-4-one
Smiles: COc1cc(/C=C/2\S/C(=N\c3ccc(cc3)C)/N(C2=O)Cc2ccccc2)cc(c1O)[N+](=O)[O-]

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Molecular Weight: 475.52
Empirical Formula: C25H21N3O5S

Physical State: Dry powder
Available Amount: 134 mg

Lipinsky:
logP: 6.664
Rotatable bonds: 4
H-donors: 1
H-acceptors: 5
PSA: 133
Number of rings: 4

     

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