COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK232969
Chemical Name: N-{5-[(2-methoxy-5-nitrobenzyl)sulfanyl]-1,3,4-thiadiazol-2-yl}-3-methylbenzamide
Smiles: COc1ccc(cc1CSc1nnc(s1)NC(=O)c1cccc(c1)C)[N+](=O)[O-]

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Molecular Weight: 416.48
Empirical Formula: C18H16N4O4S2

Physical State: Dry powder
Available Amount: 81 mg

Lipinsky:
logP: 4.623
Rotatable bonds: 5
H-donors: 1
H-acceptors: 4
PSA: 163
Number of rings: 3

     

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