COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK025723
Chemical Name: (2E)-N-{5-[(2-methoxy-5-nitrobenzyl)sulfanyl]-1,3,4-thiadiazol-2-yl}-3-phenylprop-2-enamide
Smiles: COc1ccc(cc1CSc1nnc(s1)NC(=O)/C=C/c1ccccc1)[N+](=O)[O-]

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Molecular Weight: 428.49
Empirical Formula: C19H16N4O4S2

Physical State: Dry powder
Available Amount: 171 mg

Lipinsky:
logP: 5.143
Rotatable bonds: 5
H-donors: 1
H-acceptors: 4
PSA: 163
Number of rings: 3

     

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