COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK664415
Chemical Name: ethyl4-{[3-(3-bromophenyl)-4-phenyl-5-thioxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]methyl}piperazine-1-carboxylate
Smiles: CCOC(=O)N1CCN(CC1)Cn1nc(n(c1=S)c1ccccc1)c1cccc(c1)Br

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Molecular Weight: 502.44
Empirical Formula: C22H24BrN5O2S

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 3.374
Rotatable bonds: 4
H-donors: 0
H-acceptors: 2
PSA: 83
Number of rings: 4

     

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