COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL025183
Chemical Name: N-[5-(3,4-dimethoxybenzyl)-1,3,4-thiadiazol-2-yl]-4-nitrobenzamide
Smiles: COc1ccc(cc1OC)Cc1nnc(s1)NC(=O)c1ccc(cc1)[N+](=O)[O-]

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Molecular Weight: 400.42
Empirical Formula: C18H16N4O5S

Physical State: Dry powder
Available Amount: 1 mg

Lipinsky:
logP: 3.018
Rotatable bonds: 4
H-donors: 1
H-acceptors: 5
PSA: 147
Number of rings: 3

     

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