COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK124292
Chemical Name: N-{5-[(3-acetyl-2,4,6-trimethylbenzyl)sulfanyl]-1,3,4-thiadiazol-2-yl}-2-bromobenzamide
Smiles: Cc1cc(C)c(c(c1CSc1nnc(s1)NC(=O)c1ccccc1Br)C)C(=O)C

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Molecular Weight: 490.44
Empirical Formula: C21H20BrN3O2S2

Physical State: Dry powder
Available Amount: 135 mg

Lipinsky:
logP: 5.528
Rotatable bonds: 5
H-donors: 1
H-acceptors: 2
PSA: 125
Number of rings: 3

     

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