COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK111082
Chemical Name: 2-bromo-N-(5-{[2-(3-nitrophenyl)-2-oxoethyl]sulfanyl}-1,3,4-thiadiazol-2-yl)benzamide
Smiles: O=C(c1cccc(c1)[N+](=O)[O-])CSc1nnc(s1)NC(=O)c1ccccc1Br

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Molecular Weight: 479.33
Empirical Formula: C17H11BrN4O4S2

Physical State: Dry powder
Available Amount: 147 mg

Lipinsky:
logP: 4.228
Rotatable bonds: 5
H-donors: 1
H-acceptors: 4
PSA: 171
Number of rings: 3

     

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