COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK159679
Chemical Name: (2Z,5Z)-2-[(3,5-dimethylphenyl)imino]-5-(2-hydroxy-3-methoxy-5-nitrobenzylidene)-1,3-thiazolidin-4-one
Smiles: COc1cc(cc(c1O)/C=C/1\S/C(=N\c2cc(C)cc(c2)C)/NC1=O)[N+](=O)[O-]

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Molecular Weight: 399.43
Empirical Formula: C19H17N3O5S

Physical State: Dry powder
Available Amount: 30 mg

Lipinsky:
logP: 3.666
Rotatable bonds: 3
H-donors: 2
H-acceptors: 5
PSA: 142
Number of rings: 3

     

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