COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK344901
Chemical Name: 3-bromo-4-ethoxy-N-{[5-(3-ethyl[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)-2-methylphenyl]carbamothioyl}benzamide
Smiles: CCOc1ccc(cc1Br)C(=O)NC(=S)Nc1cc(ccc1C)c1sc2n(n1)c(nn2)CC

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Molecular Weight: 545.48
Empirical Formula: C22H21BrN6O2S2

Physical State: Dry powder
Available Amount: 468 mg

Lipinsky:
logP: 6.121
Rotatable bonds: 5
H-donors: 2
H-acceptors: 2
PSA: 153
Number of rings: 4

     

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