COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK135291
Chemical Name: 2-bromo-N-[5-({2-[(3,5-dimethylphenyl)amino]-2-oxoethyl}sulfanyl)-1,3,4-thiadiazol-2-yl]benzamide
Smiles: O=C(Nc1cc(C)cc(c1)C)CSc1nnc(s1)NC(=O)c1ccccc1Br

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Molecular Weight: 477.41
Empirical Formula: C19H17BrN4O2S2

Physical State: Dry powder
Available Amount: 118 mg

Lipinsky:
logP: 4.85
Rotatable bonds: 4
H-donors: 2
H-acceptors: 2
PSA: 137
Number of rings: 3

     

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