COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK800909
Chemical Name: (5Z)-2-(3,4-dimethoxyphenyl)-5-(4-nitrobenzylidene)[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Smiles: COc1ccc(cc1OC)c1nc2n(n1)c(=O)/c(=C/c1ccc(cc1)[N+](=O)[O-])/s2

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Molecular Weight: 410.41
Empirical Formula: C19H14N4O5S

Physical State: Dry powder
Available Amount: 401 mg

Lipinsky:
logP: 5.088
Rotatable bonds: 3
H-donors: 0
H-acceptors: 5
PSA: 137
Number of rings: 4

     

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